Basic information
- CAS
25695-77-6- Standard SMILES
O=C(/C=C/c1ccccc1)Oc1ccccc1- InChIKey
NBFNGRDFKUJVIN-VAWYXSNFSA-N- Molecular formula
- C15H12O2
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.08372962
Names & identifiers
- Preferred name
- Phenyl Cinnamate
- IUPAC
- phenyl (E)-3-phenylprop-2-enoate
- English name
- 2-Propenoic acid, 3-phenyl-, phenyl ester, (2E)-
- Molecular formula
- C15H12O2
- Molecular weight
- 224.25
Names & synonyms
Phenyl cinnamate2757-04-2EINECS 220-413-1NSC 21000RefChem:172953220-413-125695-77-6Phenyl (E)-CinnamatePhenyl (E)-3-phenylacrylatephenyl (E)-3-phenylprop-2-enoatephenyl (2E)-3-phenylprop-2-enoateCHEMBL182835
Show more names
(E)-Cinnamic Acid Phenyl Ester2-Propenoic acid, 3-phenyl-, phenyl ester, (2E)-
MFCD00020657(E)-3-Phenyl-acrylic acid phenyl esterCinnamic acid, phenyl estertrans-cinnamic acid phenyl esterPhenyl (2E)-3-phenyl-2-propenoateZimtsaure-phenylesterPhenyl(E)-3-phenylacrylate2-Propenoic acid, 3-phenyl-, phenyl ester, (E)-
Database identifiers
- CAS
25695-77-6、2757-04-2- PubChem CID
- 785207
- DTXSID
DTXSID201377084- ChEMBL
CHEMBL182835- EC Number
- 220-413-1
- Nikkaji
- J299.217E、J731.140K
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 258
Experimental & physicochemical properties
SpringerMaterials PropertiesViscosity
Physicochemical properties
- Melting point
- 74.3 °C · 74.3°C
- Boiling point
- 325.66 °C · 325.66°C (rough estimate)
- Density
- 1.065 · 1.0650
- refractive index
- 1.66 · 1.6600 (estimate)
- form
- powder to crystal
- color
- White to Light yellow
- HS Code
- 2916.39 · 2916.39.7900
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2916.39.7900
Chemistry & industry
Suppliers18 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
广东顺奥化学试剂有限公司19928586137 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386, 800-988-0390 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific
Related reactions
1 records
Compound notes
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