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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H9ClO
Molecular Weight 168.62
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ALLYL-4-CHLORO-PHENOL

SMILES

OC1=C(CC=C)C=C(Cl)C=C1

InChI

InChIKey=NQZKLVHWFYHXGH-UHFFFAOYSA-N
InChI=1S/C9H9ClO/c1-2-3-7-6-8(10)4-5-9(7)11/h2,4-6,11H,1,3H2

HIDE SMILES / InChI

Molecular Formula C9H9ClO
Molecular Weight 168.62
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:22:37 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:37 GMT 2023
Record UNII
4MA4H6DQ3X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-ALLYL-4-CHLORO-PHENOL
Systematic Name English
NSC-1539
Code English
PHENOL, 4-CHLORO-2-(2-PROPEN-1-YL)-
Systematic Name English
4-CHLORO-2-ALLYLPHENOL
Systematic Name English
Code System Code Type Description
NSC
1539
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY
CAS
13997-73-4
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY
FDA UNII
4MA4H6DQ3X
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY
PUBCHEM
84143
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY
ECHA (EC/EINECS)
237-797-1
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID9074513
Created by admin on Sat Dec 16 12:22:37 GMT 2023 , Edited by admin on Sat Dec 16 12:22:37 GMT 2023
PRIMARY