Basic information
- CAS
532-08-1- Standard SMILES
C=CCc1ccc(OC(=O)C=Cc2ccccc2)c(OC)c1- InChIKey
SJKFNIODBSUYID-UHFFFAOYSA-N- Molecular formula
- C19H18O3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.12559443
Names & identifiers
- Preferred name
- Eugenol cinnamate
- IUPAC
- (2-methoxy-4-prop-2-enylphenyl) 3-phenylprop-2-enoate
- English name
- 4-allyl-2-methoxyphenyl cinnamate
- Molecular formula
- C19H18O3
- Molecular weight
- 294.34
Names & synonyms
Eugenol cinnamateDTXSID801316240RefChem:596897DTXCID701746103Cinnamyl eugenolzimmtsaures EugenolSCHEMBL42010402-methoxy-4-(prop-2-en-1-yl)phenyl 3-phenylprop-2-enoateEinecs 208-526-44-allyl-2-methoxyphenyl cinnamate2-Methoxy-4-(2-propenyl)phenol 3-phenylpropenoate2-Propenoic acid, 3-phenyl-, 2-methoxy-4-(2-propen-1-yl)phenyl ester
Database identifiers
- CAS
532-08-1- PubChem CID
- 97848
- DTXSID
DTXSID801316240
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 382
Physicochemical properties
- Boiling point
- 452 · 452.0±44.0 °C(Predicted)
- Density
- 1.113 · 1.113±0.06 g/cm3(Predicted)
- color
- White or creamy-white crystals or crystalline mass.
- Odor
- Very mild, spicy -balsamic odor.
- LogP
- 4.57 · 4.570
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410-H317
- Precautionary statements
- 273 · P273-P391-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H410-H317
- Precautionary statements
- P273-P391-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Chemistry & industry
Applications
UsesCould find some use as a fixative, but can probably not compete with the common, lower-cost fixatives of related chemical composition and similar odor type and fixative effect.
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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