3-PHENYLPROPYL CINNAMATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H18O2
Molecular Weight	266.3343
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-PHENYLPROPYL CINNAMATE

Structure Search

SMILES

O=C(OCCCC1=CC=CC=C1)\C=C\C2=CC=CC=C2

InChI

InChIKey=LYRAHIUDQRJGGZ-BUHFOSPRSA-N

InChI=1S/C18H18O2/c19-18(14-13-17-10-5-2-6-11-17)20-15-7-12-16-8-3-1-4-9-16/h1-6,8-11,13-14H,7,12,15H2/b14-13+

HIDE SMILES / InChI

Molecular Formula	C18H18O2
Molecular Weight	266.3343
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:29:15 GMT 2023` Edited by `admin` on `Fri Dec 15 17:29:15 GMT 2023`
Record UNII	F0Q8B0FS94
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-PHENYLPROPYL CINNAMATE

Systematic Name

English

3-PHENYLPROPYL 3-PHENYL-2-PROPENOATE

Systematic Name

English

2-PROPENOIC ACID, 3-PHENYL-, 3-PHENYLPROPYL ESTER, (2E)-

Systematic Name

English

2-PROPENOIC ACID, 3-PHENYL-, 3-PHENYLPROPYL ESTER

Common Name

English

3-PHENYLPROPYL CINNAMATE [FHFI]

Common Name

English

FEMA NO. 2894

Code

English

CINNAMIC ACID, 3-PHENYLPROPYL ESTER

Common Name

English

Classification Tree Code System Code

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

JECFA EVALUATION

3-PHENYLPROPYL CINNAMATE

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

Code System Code Type Description

MESH

C571596

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

CAS

122-68-9

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

EPA CompTox

DTXSID9047411

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

ECHA (EC/EINECS)

204-565-6

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

CAS

290311-72-7

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

FDA UNII

F0Q8B0FS94

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

PUBCHEM

5320530

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY

JECFA MONOGRAPH

697

Created by admin on Fri Dec 15 17:29:15 GMT 2023 , Edited by admin on Fri Dec 15 17:29:15 GMT 2023

PRIMARY