cis-Coniferyl alcohol

Base Information

• Chemical Name: cis-Coniferyl alcohol
• CAS No.: 69056-21-9
• Molecular Formula: C10H12O3
• Molecular Weight: 180.203
• UNII: ASW5FSM5Z0
• Nikkaji Number: J246.060B
• Metabolomics Workbench ID: 70046
• ChEMBL ID: CHEMBL2088631
• Mol file: 69056-21-9.mol

Synonyms:cis-coniferyl alcohol;(Z)-Coniferyl Alcohol;ASW5FSM5Z0;Coniferyl alcohol, (Z)-;UNII-ASW5FSM5Z0;bmse010156;4-[(Z)-3-hydroxyprop-1-enyl]-2-methoxyphenol;4-((1Z)-3-Hydroxy-1-propen-1-yl)-2-methoxyphenol;Phenol, 4-(3-hydroxy-1-propenyl)-2-methoxy-, (Z)-;69056-21-9;Phenol, 4-((1Z)-3-hydroxy-1-propen-1-yl)-2-methoxy-;Phenol, 4-(3-hydroxy-1-propenyl)-2-methoxy-;AC1LU7QP;Coniferyl alcohol, cis;Phenol, 4-(3-hydroxy-1-propen-1-yl)-2-methoxy-;CHEMBL2088631;AKOS025401152;4-[(Z)-3-hydroxyprop-1-enyl]-2-methoxy-phenol

Chemical Property of cis-Coniferyl alcohol

Chemical Property:

• PSA: 49.69000
• LogP: 1.40630
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 180.078644241
• Heavy Atom Count: 13
• Complexity: 168

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C=CCO)O
• Isomeric SMILES: COC1=C(C=CC(=C1)/C=C\CO)O

Technology Process of cis-Coniferyl alcohol

There total 45 articles about cis-Coniferyl alcohol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

(E)-3-(4-hydroxy-3-methoxyphenyl)allyl acetate (94930-81-1) → coniferal alcohol (458-35-5,32811-40-8,69056-21-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at -10 ℃; for 0.5h;

DOI:10.1021/jo00207a006

Reference yield: 99.7%

trans-coniferyl aldehyde (458-36-6) → coniferal alcohol (458-35-5,32811-40-8,69056-21-9)

Guidance literature:

With sodium tetrahydroborate; In ethanol; for 0.166667h;

DOI:10.1016/S0040-4020(00)00873-5

Reference yield: 98.0%

(E)-3-(4-hydroxy-3-methoxyphenyl)acrylic acid (1135-24-6,537-98-4) → coniferal alcohol (458-35-5,32811-40-8,69056-21-9)

Guidance literature:

With ATP; NADPH; magnesium chloride; In aq. phosphate buffer; at 30 ℃; for 18h; pH=7.5; Green chemistry; Enzymatic reaction;

DOI:10.1039/c9gc02359c

upstream raw materials:

vanillin acetate

3-methoxy-4-(ethoxyethylidene-oxy)-benzaldehyde

1,1-dibromo-2-(3-methoxy-4-ethoxyethylideneoxyphenyl)ethylene

1-carbomethoxy-2-(3-methoxy-4-ethoxyethylideneoxyphenyl)acetylene

Downstream raw materials:

(Z)-coniferyl alcohol diacetate

(+/-)-1c,4c-bis-[4-(2,4-dinitro-phenoxy)-3-methoxy-phenyl]-(3ar,6ac)-tetrahydro-furo[3,4-c]furan

(+/-)-pinoresinol

coniferyl alcohol 2,4-dinitrophenyl ether