Hexyl acetate - CP, ≥98% , CAS No.142-92-7

CAS: 142-92-7 Cat. No.: H111062 Peso molecular: 144.21 Beilstein Registry Number: 1747138 Número EC: 205-572-7
Disponible para pedir
GRADE & PURITY CP ? Chemically Pure grade — moderate purity above technical grade but below analytical. Use for general lab reactions where ultra-low impurities aren't critical. ≥98%
Synonyms
DSSTox_CID_2006 | EINECS 205-572-7 | Hexyl acetate, 99% | ACETIC ACID, HEXYL ESTER | Hexyl acetate, >=98%, FCC, FG | 4-02-00-00159 (Beilstein Handbook Reference) | A0032 | Acetic acid-hexyl ester | DSSTox_GSID_29061 | DTXCID602006 | l-Hexyl acetate | FEMA
Storage
Room temperature
Shipped In
FedEx DG Service
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
100ml
H111062-100ml
8

11,90US$

13,90US$
Guardar 2,00 US$ (14.39%)
500ml
H111062-500ml
2

34,90US$

49,90US$
Guardar 15,00 US$ (30.06%)
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Why this grade

CP, ≥98% CP for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 16 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Hexyl acetate was used to study the activity of diamondback moth sex pheromone and larval frass volatiles, as well as green leaf volatiles from cabbage, on the natural enemies of the pest.

Specifications

Sinónimos
DSSTox_CID_2006 | EINECS 205-572-7 | Hexyl acetate, 99% | ACETIC ACID, HEXYL ESTER | Hexyl acetate, >=98%, FCC, FG | 4-02-00-00159 (Beilstein Handbook Reference) | A0032 | Acetic acid-hexyl ester | DSSTox_GSID_29061 | DTXCID602006 | l-Hexyl acetate | FEMA
Especificaciones y pureza
CP, ≥98%
Mecanismos bioquímicos y fisiológicos
Hexyl acetate has antimicrobial activity and can be used to improve the safety of minimally processed fruits. Hexyl acetate is a fruity smelling fluid used as flavoring agent or in perfumes. Hexyl acetate is a green leaf volatile from cabbage Brassica ole
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
CP
Pureza
≥98%
Nombres e identificadores
Pubchem Sid504751763
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504751763
Sonrisas canónicasCCCCCCOC(=O)C
IUPAC Namehexyl acetate
InChIKeyAOGQPLXWSUTHQB-UHFFFAOYSA-N
INCHI1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3
Isómeros SMILES CCCCCCOC(=O)C
WGK Alemania 1
RTECS AI0875000
Número ONU 1993
Grupo de embalaje I
Peso molecular 144.21
Beilstein 1747138
Reaxy-Rn 1747138
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1747138&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClaseCarboxylic acids and derivatives
SubclassCarboxylic acid derivatives
Intermediate Tree Nodes Not available
Direct ParentCarboxylic acid esters
Alternative Parents Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
External Descriptors Wax monoesters
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (no humanos)
Plutella xylostella (1838 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Bursaphelenchus xylophilus (372 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

17 results found

Lot NumberCertificate TypeFechaArticulo
H2220393Certificate of AnalysisJun 08, 2026 H111062
H2220376Certificate of AnalysisJun 08, 2026 H111062
F2506601Certificate of AnalysisMay 26, 2025 H111062
F2506510Certificate of AnalysisMay 26, 2025 H111062
F2506600Certificate of AnalysisMay 26, 2025 H111062
F2503336Certificate of AnalysisMay 26, 2025 H111062
F2503337Certificate of AnalysisMay 26, 2025 H111062
F2503362Certificate of AnalysisMay 26, 2025 H111062
C2513508Certificate of AnalysisMar 05, 2025 H111062
C2517791Certificate of AnalysisMar 05, 2025 H111062
C2513456Certificate of AnalysisMar 05, 2025 H111062
K2313455Certificate of AnalysisNov 07, 2023 H111062
K2313456Certificate of AnalysisNov 07, 2023 H111062
K2313457Certificate of AnalysisNov 07, 2023 H111062
H1518064Certificate of AnalysisApr 13, 2023 H111062
D2314559Certificate of AnalysisAug 12, 2022 H111062
H2222051Certificate of AnalysisAug 12, 2022 H111062

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Propiedades químicas y físicas
Índice de refracción1.409
Punto de inflamación (°F)131 °F
Punto de inflamación (°C)43℃
Punto de ebullición (°C)169.2°C
Punto de fusión (°C)-80°C
Peso molecular144.210 g/mol
XLogP32.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass144.115 Da
Monoisotopic Mass144.115 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count10
Formal Charge0
Complexity89.300
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Citations of This Product
Referencias
1. Yu Mu, Jun Huang, Rongqing Zhou, Suyi Zhang, Hui Qin, Hanlan Tang, Qianglin Pan, Huifang Tang.  (2023)  Characterization of the differences in aroma-active compounds in strong-flavor Baijiu induced by bioaugmented Daqu using metabolomics and sensomics approaches.  FOOD CHEMISTRY,      [PMID:37247603] [10.1016/j.foodchem.2023.136429]
2. Die Hu, Wei Chen, Aiqing Miao, Xiaoyan Qiao, Hongling Xia, Chengying Ma.  (2023)  Analysis of volatile emission of tea (Camellia sinensis) shoots in response to temperature-dependent postharvest treatments.  EUROPEAN JOURNAL OF AGRONOMY,      [PMID:] [10.1016/j.eja.2023.126821]
3. Jing Li, Youyou Yang, Chaohua Tang, Shengnan Yue, Qingyu Zhao, Fadi Li, Junmin Zhang.  (2022)  Changes in lipids and aroma compounds in intramuscular fat from Hu sheep.  FOOD CHEMISTRY,      [PMID:35413762] [10.1016/j.foodchem.2022.132611]
4. Wei Fu, Linxin Xu, Qiwen Yu, Jiajia Fang, Guohua Zhao, Yi Li, Chenying Pan, Hao Dong, Di Wang, Haiyan Ren, Yi Guo, Qingjun Liu, Jun Liu, Xing Chen.  (2022)  Artificial Intelligent Olfactory System for the Diagnosis of Parkinson’s Disease.  ACS Omega,      [PMID:35155895] [10.1021/acsomega.1c05060]
5. Zi Ye, Zhixun Shang, Meiqi Li, Yonghan Qu, Hongjin Long, Junjie Yi.  (2020)  Evaluation of the physiochemical and aromatic qualities of pickled Chinese pepper (Paojiao) and their influence on consumer acceptability by using targeted and untargeted multivariate approaches.  FOOD RESEARCH INTERNATIONAL,      [PMID:33233164] [10.1016/j.foodres.2020.109535]
6. Xuyang Xiong, Liyong Ding, Qingqian Wang, Yongxiu Li, Qingqing Jiang, Juncheng Hu.  (2016)  Synthesis and photocatalytic activity of BiOBr nanosheets with tunable exposed {0 1 0} facets.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2016.02.018]
7. Hao Chen, Yingwu Luo.  (2011)  Facile Synthesis of Nanocapsules and Hollow Nanoparticles Consisting of Fluorinated Polymer Shells by Interfacial RAFT Miniemulsion Polymerization.  MACROMOLECULAR CHEMISTRY AND PHYSICS,  212  (7): (737-743).  [PMID:] [10.1002/macp.201000664]
8. Sanyan Lai, Ning Yi, Shixin Yin, Yipeng Huang, Tianlin Shen, Qianying Dai, Liping Gao, Xiaolan Jiang, Tao Xia.  (2024)  Biochemical characterization of CsCXEs: Carboxylesterase enhances the biosynthesis of green odor volatiles during tea processing.  Horticultural Plant Journal,      [PMID:] [10.1016/j.hpj.2024.08.001]
9. Wenyi Duan, Zhenyu Yao, Chengkui Qiao, Junren Meng, Shihang Sun, Lei Pan, Liang Niu, Guochao Cui, Zhiqiang Wang, Wenfang Zeng.  (2025)  Combined volatile metabolome and transcriptome analysis of 60 peach cultivars provide new insights into the formation of aroma and the identification of associated genes.  Horticultural Plant Journal,      [PMID:] [10.1016/j.hpj.2024.12.005]
10. Xiaoying Li, Chunsheng Liu, Junkai Wu, Kai Su, Xiao Xiao, Libin Zhang, B. Loye Eberhart, Caixia Chen, Fuhang Song.  (2025)  Comprehensive investigation on the dynamic changes of volatile organic compounds in three peach cultivars during fruit development.  FOOD RESEARCH INTERNATIONAL,      [PMID:40022387] [10.1016/j.foodres.2025.115866]
11. Xiaoying Li, Chunsheng Liu, Junkai Wu, Xiao Xiao, Libin Zhang, Caixia Chen, Annette S. Wilson, Fuhang Song.  (2024)  Ester-related volatile compounds reveal the diversity and commonalities of different types of late-ripening peaches.  JOURNAL OF FOOD SCIENCE,  89  (3): (1485-1497).  [PMID:38317483] [10.1111/1750-3841.16943]
12. Mingming Zhao, Zhiheng You, Huayun Chen, Xiao Wang, Yibin Ying, Yixian Wang.  (2024)  Integrated Fruit Ripeness Assessment System Based on an Artificial Olfactory Sensor and Deep Learning.  Foods,  13  (5): (793).  [PMID:38472906] [10.3390/foods13050793]
13. Mingming Zhao, Huizi Lu, Zhiheng You, Huayun Chen, Xiao Wang, Yaqing Zhang, Yixian Wang.  (2024)  Olfactory Visualization Sensing Array Made with CelluMOFs to Predict Fruit Ripeness Using Deep Learning.  ACS Applied Materials & Interfaces,      [PMID:39403818] [10.1021/acsami.4c09402]
14. Yue Wang, Jianing Li, Tingting Zhu, Yiran Li, Jinyu Yang, Tingting Ma, Yulin Fang, Xiangyu Sun.  (2025)  Unveiling sub-regional aroma differences in China's Ningxia region: Characterization of key aroma profiles and chemical foundations via sensomics and RATA.  FOOD CHEMISTRY,      [PMID:41045857] [10.1016/j.foodchem.2025.146557]
15. Xiaoying Li, Gang Li, Haijing Wang, Chunsheng Liu, Chunrui Rong, Fuhang Song, Caixia Chen, Junkai Wu.  (2025)  Characterization of volatile flavor profiles in three peach cultivars during postharvest storage at various temperatures using HS-SPME-GC–MS.  Food Chemistry-X,      [PMID:40497035] [10.1016/j.fochx.2025.102554]
16. Mei Chen, Fengyun Tian, Youshudi Xie, Jie Ma, Yanfen Yang, Changli Yang, Xinrong Zhou, Tian Deng, Houhong Xiao, Xue Dong, Dingli Chen, Xinlong Dai, Zhi zhou, Shimao Fang.  (2025)  A comprehensive study of carboxylesterases involved in the degradation of volatile esters in horticultural crops.  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2025.122039]
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