Basic information
- CAS
7778-83-8- Standard SMILES
CCCOC(=O)C=Cc1ccccc1- InChIKey
OLLPXZHNCXACMM-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- Propyl 3-phenylprop-2-enoate
- IUPAC
- propyl 3-phenylprop-2-enoate
- English name
- Propyl cinnamate
- Molecular formula
- C12H14O2
- Molecular weight
- 190.24
Names & synonyms
propyl 3-phenylprop-2-enoateZimtsaurepropylesterSCHEMBL133147SCHEMBL9113584AKOS017265240FEMA 2938Propyl ciamatePROPYL CINNAMATEN-PROPYL CINNAMATEn-Propylcinnamate,98%Propyl 3-Phenylacrylatecinnamicacidpropylester
Show more names
cinnamicacid,propylesterPropyl Cinnamate(kosher)Propyl 3-phenylpropenoate
Database identifiers
- CAS
7778-83-8- PubChem CID
- 24508
- DTXSID
DTXSID8064802
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 190
Experimental & physicochemical properties
SpringerMaterials PropertiesDielectric constant
Physicochemical properties
- Boiling point
- 282 · 282-284°C
- Density
- 1 · 1,025 g/cm3
- refractive index
- 1.553 · 1.5530
- FEMA
- 2938 · 2938 | PROPYL CINNAMATE
- FLAVIS Number
- 9.731 · 09.731 | Propyl cinnamate
- Flash point
- 99 °C · >99°C
- storage temp.
- Sealed in dry,Room Temperature
- Odor
- 100 % · at 100.00 %. musty vine amber
- Odor Type
- balsamic
- JECFA Number
- 660 · 660
- BRN
- 2044816 · 2044816
- LogP
- 3.477 · 3.477 (est)
- CAS DataBase Reference
- 7778 · 7778-83-8(CAS DataBase Reference)
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
- tsca
- TSCA listed
- rtecs
- GE0525000
- risk_code
- 51/53
- Symbol(GHS)
- GHS09
- hazard_code
- N
- safety_code
- 24/25-61
- Hazard statements
- H411-H226
Chemistry & industry
Applications
UsesPropyl cinnamate is used as an insect repellant.
Preparation methods
PreparationBy esterification of cinnamic acid with propyl alcohol in the presence of HCl as a catalyst; or by direct esterification in the presence of benzene.
Suppliers100 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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