Coniferyl alcohol - 10mM in DMSO , CAS No.458-35-5

CAS: 458-35-5 Cat. No.: C424076 Molecular Weight: 180.2 EC Number: 207-277-9

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Coniferyl alcohol - 10mM in DMSO CAS No(458-35-5) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY 10mM in DMSO

Synonyms

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Citations of This Product References Solution Calculators Reviews

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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.

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

Overview

Coniferyl alcohol is one of the preferred substrate of the eucalpytus globus enzyme.

Specifications

Synonyms

Specifications & Purity

10mM in DMSO

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

Canonical Smiles	COC1=C(C=CC(=C1)C=CCO)O
IUPAC Name	4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenol
InChIKey	JMFRWRFFLBVWSI-NSCUHMNNSA-N
INCHI	1S/C10H12O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,7,11-12H,6H2,1H3/b3-2+
Isomeric SMILES	COC1=C(C=CC(=C1)/C=C/CO)O
WGK Germany	3
Molecular Weight	180.2
Reaxy-Rn	2048961
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2048961&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

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass Methoxyphenols

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	Methoxyphenols
Intermediate Tree Nodes	Not available
Direct Parent	Methoxyphenols
Alternative Parents	Cinnamyl alcohols Styrenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Primary alcohols Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Cinnamyl alcohol - Methoxyphenol - Phenoxy compound - Anisole - Methoxybenzene - Styrene - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as methoxyphenols. These are compounds containing a methoxy group attached to the benzene ring of a phenol moiety.
External Descriptors	Coniferyl alcohol derivatives
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

LoVo (4724 Activities)

Sensitivity	Light sensitive;Air sensitive
Boil Point(°C)	163-165 °C/3 mmHg
Melt Point(°C)	75-80°C
Molecular Weight	180.200 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	180.079 Da
Monoisotopic Mass	180.079 Da
Topological Polar Surface Area	49.700 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	168.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

1. Miaolian Ma, Wanpeng Zhou, Yu Zhang, Qisen Huang, Zhixuan Hu, Liuzhang Ouyang. (2023) Natural lignin as efficient catalyst for H2 production from NaBH4 methanolysis at low temperature. Journal of Environmental Chemical Engineering, [PMID:] [10.1016/j.jece.2023.111615]
2. Xu Yu, Li Yu, Fei Ma, Peiwu Li. (2020) Quantification of phenolic compounds in vegetable oils by mixed-mode solid-phase extraction isotope chemical labeling coupled with UHPLC-MS/MS. FOOD CHEMISTRY, [PMID:32721834] [10.1016/j.foodchem.2020.127572]
3. Peng-Cheng Chen, Hui Zhang, Pu Zheng. (2018) Direct biodegradation of eugenol to coniferyl aldehyde and other higher value-added products by Gibberella fujikuroi ZH-34. ELECTRONIC JOURNAL OF BIOTECHNOLOGY, [PMID:] [10.1016/j.ejbt.2018.12.001]
4. Kai Li, Yuan Wang, Xiao Guo, Bo Wang. (2024) Effects of Lignin-Diverted Reductant with Polyphenol Oxidases on Cellulose Degradation by Wild and Mutant Types of Lytic Polysaccharide Monooxygenase. CURRENT ISSUES IN MOLECULAR BIOLOGY, 46 (4): (3694-3712). [PMID:38666960] [10.3390/cimb46040230]
5. Yajun Li, Runhui Li, Junzhong Shang, Kaige Zhao, Yaqi Sui, Zhenhua Liu, Huijun Yan, Manzhu Bao, Mei Liang, Qiao Zhao, Yao-Wu Yuan, Guogui Ning. (2025) A de novo-originated gene drives rose scent diversification. CELL, [PMID:40902596] [10.1016/j.cell.2025.08.011]
6. Simin Bi, Jianpeng Ao, Ting Jiang, Xianmiao Zhu, Yimin Zhu, Weibing Yang, Binglian Zheng, Minbiao Ji. (2024) Imaging Metabolic Flow of Water in Plants with Isotope-Traced Stimulated Raman Scattering Microscopy. Advanced Science, 11 (42): (2407543). [PMID:39301930] [10.1002/advs.202407543]
7. Jiazeng Yang, Jincai Liang, Lei Shao, Lihong Liu, Ke Gao, Jun-Liang Zhang, Zhenjiao Sun, Wendong Xu, Pengcheng Lin, Rongmin Yu, Jiachen Zi. (2020) Green production of silybin and isosilybin by merging metabolic engineering approaches and enzymatic catalysis. METABOLIC ENGINEERING, [PMID:32004707] [10.1016/j.ymben.2020.01.007]
8. Yunxuan Liu, Xinjia Wang, Rong Lian, Yan Zhao, Yurong Zhou, Yuan Yu, Wenqin She, Zhixiong Guo, Heli Pan, Tengfei Pan. (2026) Genome-Wide Identification of CmPOD Genes and Partial Functional Characterization of CmPOD52 in Lignin-Related Granulation of ‘Sanhong’ Pomelo (Citrus maxima). Horticulturae, 12 (1): (106). [PMID:] [10.3390/horticulturae12010106]