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

CAS: 458-35-5 Cat. No.: C424076 Summenformel: C₁₀H₁₂O₃ Molekulargewicht: 180.2 EG-Nummer: 207-277-9

GRADE & PURITY 10mM in DMSO

Synonyms

CONIFERYL ALCOHOL|458-35-5|Coniferol|4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenol|32811-40-8|(E)-Coniferyl alcohol|trans-Coniferyl alcohol|gamma-Hydroxyisoeugenol|Coniferyl alcohol, E-|4-Hydroxy-3-methoxycinnamic alcohol|3-(4-Hydroxy-3-methoxyphenyl)-2-pro

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

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

Specifications

Synonyme

CONIFERYL ALCOHOL | 458-35-5 | Coniferol | 4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenol | 32811-40-8 | (E)-Coniferyl alcohol | trans-Coniferyl alcohol | gamma-Hydroxyisoeugenol | Coniferyl alcohol, E- | 4-Hydroxy-3-methoxycinnamic alcohol | 3-(4-Hydroxy-3-methoxyphenyl)-2-pro

Spezifikationen & Reinheit

10mM in DMSO

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

• Pubchem Sid: 528772138
• Kanonisches Lächeln: 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+
• Isomere SMILES: COC1=C(C=CC(=C1)/C=C/CO)O
• WGK Deutschland: 3
• Molekulargewicht: 180.2
• Reaxy-Rn: 2048961
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2048961&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenols
      • Subclass Methoxyphenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: 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
• Beschreibung: 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

Data sources

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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive;Air sensitive
• Siedepunkt (°C): 163-165 °C/3 mmHg
• Schmelzpunkt (°C): 75-80°C
• Molekulargewicht: 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 Ų
• 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

Referenzen

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]

9. Jiazeng Yang, Yajing Fan, Howard H. Chou.  (2026)  Metal ions program flavonolignan biosynthesis and enable photo-biohybrid production.  METABOLIC ENGINEERING,      [PMID:42501857] [10.1016/j.ymben.2026.102506]