2-Propenoic acid,3-(3,4-dihydroxyphenyl)-,3-methyl-2-buten-1-yl ester,(2E)-

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CAS
118971-61-2
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Purity
96%
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Catalog Number

ACM118971612

Product Name

2-Propenoic acid,3-(3,4-dihydroxyphenyl)-,3-methyl-2-buten-1-yl ester,(2E)-

Structure

CAS

118971-61-2

Category

Heterocyclic Organic Compound

Synonyms

KAFFEESURE-1,1-DIMETHYLALLYLESTER; isopentenyl caffeate; prenyl caffeate; 1,1-Dimethylallyl caffeate,1,1-Dimethylallyl caffeic acid ester,3-Methyl-2-butenyl caffeate; Caffeic acid 1,1-dimethylallyl ester; 3,3-dimethylallyl caffeate;

IUPAC Name

3-methylbut-2-enyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Molecular Weight

248.276

Molecular Formula

C₁₄H₁₆O₄

Canonical SMILES

CC(=CCOC(=O)C=CC1=CC(=C(C=C1)O)O)C

InChI Key

TTYOHMFLCXENHR-GQCTYLIASA-N

Boiling Point

417.5ºC at 760mmHg

Flash Point

156.1ºC

Density

1.201g/cm³

Exact Mass

248.10500

H-Bond Acceptor

H-Bond Donor

MSDS

Download MSDS

COA

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Spec Sheet

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