Linalyl Acetate - 10mM in DMSO , CAS No.115-95-7

CAS: 115-95-7 Cat. No.: L420739 Peso molecular: 196.29 Beilstein Registry Number: 1724500 Número EC: 204-116-4
Disponible para pedir
GRADE & PURITY 10mM in DMSO
Synonyms
(-)-S-Linalyl acetate | Lynalyl acetate | Linalyl acetate, >=97%, FCC, FG | LINALYL ACETATE [MI] | Q188314 | 1, 3,7-dimethyl-, acetate | CHEBI:6469 | LINALYL ACETATE [HSDB] | UNII-5K47SSQ51G | 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate | 3,7-Dimethyl-1,6-o
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
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Size
Estado
Price
Qty
1ml
L420739-1ml
1
34,90US$
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

📋

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 11 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Linalyl acetate is the main component of many plant essential oils such as lavender oil.It can be used as a flavoring agentand fragrance ingredient.

Specifications

Sinónimos
(-)-S-Linalyl acetate | Lynalyl acetate | Linalyl acetate, >=97%, FCC, FG | LINALYL ACETATE [MI] | Q188314 | 1, 3, 7-dimethyl-, acetate | CHEBI:6469 | LINALYL ACETATE [HSDB] | UNII-5K47SSQ51G | 1, 6-Octadien-3-ol, 3, 7-dimethyl-, acetate | 3, 7-Dimethyl-1, 6-o
Especificaciones y pureza
10mM in DMSO
Condiciones de almacenamiento de almacenamiento
Store at -80°C
Enviado en
Dry ice packs + Cold packs
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores
Sonrisas canónicasCC(=CCCC(C)(C=C)OC(=O)C)C
IUPAC Name3,7-dimethylocta-1,6-dien-3-yl acetate
InChIKeyUWKAYLJWKGQEPM-UHFFFAOYSA-N
INCHI1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3
Isómeros SMILES CC(=CCCC(C)(C=C)OC(=O)C)C
WGK Alemania 1
RTECS RG5910000
Peso molecular 196.29
Beilstein 1724500
Reaxy-Rn 1724497
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1724497&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
SuperclassLipids and lipid-like molecules
ClasePrenol lipids
SubclassMonoterpenoids
Intermediate Tree Nodes Not available
Direct ParentAcyclic monoterpenoids
Alternative Parents Carboxylic acid esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Acyclic monoterpenoid - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - 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 acyclic monoterpenoids. These are monoterpenes that do not contain a cycle.
External Descriptors acetate ester - monoterpenoid
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Aspergillus flavus (8875 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mycoplasmoides pneumoniae (351 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Leptinotarsa decemlineata (1161 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Psoroptes ovis (78 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Sclerotinia sclerotiorum (877 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Metamycoplasma hominis (88 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Fusarium oxysporum f. sp. dianthi (4 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:
Propiedades químicas y físicas
Índice de refracción1.453
Punto de inflamación (°F)201.2 °F
Punto de inflamación (°C)94 °C
Punto de ebullición (°C)220°C
Peso molecular196.290 g/mol
XLogP33.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass196.146 Da
Monoisotopic Mass196.146 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count14
Formal Charge0
Complexity237.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
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. Nan He, Chunxiao Zhang, Kaiyang Hou, Hongxiao Yu, Donghai Zhang, Mengying Chen, Kaiqiang Zhang, Xu Wang.  (2023)  A comprehensive study on flavor/cyclodextrin inclusion complexes.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2023.132613]
2. Peixi Zhu, Mengya Hao, Feng Su, Wenhao Xu, Qihong Zhang, Weike Su, Erwin Adams.  (2022)  Mechanochemical-assisted extraction of essential oils from Citrus aurantium L. var. amara Engl..  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2022.115703]
3. Li Yuling, Wu Weifeng, Jian Rongchao, Ren Xiaofei, Chen Xiaole, Hong Weiqian David, Wu Min, Cai Jinglin, Lao Canyao, Xu Ximing, Sheng Zhaojun.  (2022)  Larvicidal, acetylcholinesterase inhibitory activities of four essential oils and their constituents against Aedes albopictus, and nanoemulsion preparation.  JOURNAL OF PEST SCIENCE,  96  (3): (961-971).  [PMID:] [10.1007/s10340-022-01555-8]
4. Yongfeng Wang, Qingqing Cheng, Jian Liu, Zeeshan Tariq, Zhaozhu Zheng, Gang Li, David L. Kaplan, Xiaoqin Wang.  (2020)  Tuning Microcapsule Shell Thickness and Structure with Silk Fibroin and Nanoparticles for Sustained Release.  ACS Biomaterials Science & Engineering,      [PMID:33455196] [10.1021/acsbiomaterials.0c00835]
5. Ping Chen, Bing Liu, Xin Liu, Jihong Fu.  (2019)  Ultrasound-assisted extraction and dispersive liquid–liquid microextraction coupled with gas chromatography-mass spectrometry for the sensitive determination of essential oil components in lavender.  Analytical Methods,  11  (11): (1541-1550).  [PMID:] [10.1039/C8AY02687D]
6. Wenqian Li, Hao Shi, Huaihai Ding, Liangliang Wang, Yu Zhang, Xun Li, Fei Wang.  (2018)  Characterization of two novel thermostable esterases from Thermoanaerobacterium thermosaccharolyticum.  PROTEIN EXPRESSION AND PURIFICATION,      [PMID:29684442] [10.1016/j.pep.2018.04.010]
7. Xinming Chen, Dandan Yang, Lin Huang, Mengqi Li, Jihai Gao, Can Liu, Xiaoming Bao, Zhizhi Huang, Jinhui Yang, Haozhou Huang, Dingkun Zhang, Runchun Xu.  (2024)  Comparison and identification of aroma components in 21 kinds of frankincense with variety and region based on the odor intensity characteristic spectrum constructed by HS–SPME–GC–MS combined with E-nose.  FOOD RESEARCH INTERNATIONAL,      [PMID:39277220] [10.1016/j.foodres.2024.114942]
8. Xiaoming Zeng, Hao He, Liejiang Yuan, Haizhi Wu, Cong Zhou.  (2024)  Determination of 24 Trace Aromatic Substances in Rosemary Hydrosol by Dispersed Liquid–Liquid Microextraction–Gas Chromatography.  Processes,  12  (3): (498).  [PMID:] [10.3390/pr12030498]
9. Jian Hong, Qiang Wang, Biao Liu, Tao Li, Dingkai Hu, Furqan Muhammad.  (2024)  Isothermal Vapor–Liquid Equilibrium for Linalool + Linalyl Acetate, Linalool + α-Terpineol, and α-Terpineol + Linalyl Acetate Systems Using Headspace Gas Chromatography.  JOURNAL OF CHEMICAL AND ENGINEERING DATA,      [PMID:] [10.1021/acs.jced.3c00736]
10. Hafiz Abdul Rasheed, Abdur Rehman, Xiaochen Chen, Tariq Aziz, Fahad Al-Asmari, Majid Alhomrani, Abdulhakeem S. Alamri, Haiying Cui, Lin Lin.  (2024)  Unveiling the anti-listerial effect of Citrus bergamia essential oil: Mechanism of membrane disruption and anti-hemolytic activity.  Food Bioscience,      [PMID:] [10.1016/j.fbio.2024.104742]
11. Wang Lei, Hu Hanlu, Sun Xiaoxia, Jiao Ziwei, Zhang Hao, Luo Weikang, Huang Xiaode.  (2026)  Exploring the antibacterial mechanism and application of lavender essential oil based on network pharmacology and molecular docking.  Scientific Reports,      [PMID:] [10.1038/s41598-026-52170-x]
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