U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H9Cl
Molecular Weight 152.621
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CINNAMYL CHLORIDE

SMILES

ClC\C=C\C1=CC=CC=C1

InChI

InChIKey=IWTYTFSSTWXZFU-QPJJXVBHSA-N
InChI=1S/C9H9Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2/b7-4+

HIDE SMILES / InChI
Molecular Formula C9H9Cl
Molecular Weight 152.621
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Unknown
139594
Patents

Patents

20020020832
1
20020028337
1
JP2000129010A
1
JP2000262894A
1
JP2001072619A
1
JP2001072621A
1
JP2006504850A
2
JP2009215499A
1
JP4833465B2
6
JPH00288641A
1
JPH01204922A
1
JPH0286608A
1
JPH0411618A
1
JPH04133065A
1
JPH04343070A
1
JPH05255450A
1
JPH05271652A
1
JPH05287010A
1
JPH07216022A
1
JPH0741574A
1
JPH08120036A
1
JPH08157504A
1
JPS57121012A
1
JPS58164603A
1
JPS5861170A
1
JPS6088008A
1
JPS61157542A
1
JPS61205931A
1
JPS61205932A
1
JPS62104814A
1
JPS62227450A
1
JPS63115838A
3
JPS6395235A
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:40:00 GMT 2023
Edited
by admin
on Fri Dec 15 19:40:00 GMT 2023
Record UNII
2I1ADL56TX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CINNAMYL CHLORIDE
Systematic Name English
(E)-3-PHENYL-2-PROPEN-1-YL CHLORIDE
Systematic Name English
BENZENE, (3-CHLOROPROPENYL)-, (E)-
Common Name English
BENZENE, ((1E)-3-CHLORO-1-PROPEN-1-YL)-
Systematic Name English
.BETA.-CHLOROMETHYLSTYRENE
Systematic Name English
NSC-5599
Code English
TRANS-3-CHLORO-1-PHENYLPROP-1-ENE
Systematic Name English
TRANS-CINNAMYL CHLORIDE
Systematic Name English
(E)-CINNAMYL CHLORIDE
Systematic Name English
(E)-3-CHLORO-1-PHENYLPROPENE
Systematic Name English
BENZENE, (3-CHLORO-1-PROPEN-1-YL)-
Systematic Name English
CINNAMYL CHLORIDE, 95% TRANS
Common Name English
BENZENE, (3-CHLORO-1-PROPENYL)-, (E)-
Common Name English
BENZENE, ((1E)-3-CHLORO-1-PROPENYL)-
Systematic Name English
TRANS-3-CHLORO-1-PHENYLPROPENE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
220-246-4
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
NSC
5599
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
CAS
21087-29-6
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
PUBCHEM
639658
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID6062591
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
FDA UNII
2I1ADL56TX
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
PRIMARY
CAS
2687-12-9
Created by admin on Fri Dec 15 19:40:00 GMT 2023 , Edited by admin on Fri Dec 15 19:40:00 GMT 2023
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