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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H13ClO
Molecular Weight 184.663
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO-3-METHYL-2-PROPAN-2-YLPHENOL

SMILES

CC(C)C1=C(C)C(Cl)=CC=C1O

InChI

InChIKey=JSOXHHYKGWBWGR-UHFFFAOYSA-N
InChI=1S/C10H13ClO/c1-6(2)10-7(3)8(11)4-5-9(10)12/h4-6,12H,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H13ClO
Molecular Weight 184.663
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 12:35:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:35:22 GMT 2023
Record UNII
BO5VQM4V2C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO-3-METHYL-2-PROPAN-2-YLPHENOL
Systematic Name English
PHENOL, 4-CHLORO-3-METHYL-2-(1-METHYLETHYL)-
Systematic Name English
4-CHLORO-2-ISOPROPYL-M-CRESOL
Systematic Name English
PARA CHLORO THYMOL VICINAL
Common Name English
4-CHLORO-3-METHYL-2-(1-METHYLETHYL)PHENOL
Systematic Name English
4-CHLORO-2-ISOPROPYL-3-METHYLPHENOL
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
256-898-1
Created by admin on Sat Dec 16 12:35:22 GMT 2023 , Edited by admin on Sat Dec 16 12:35:22 GMT 2023
PRIMARY
CAS
50992-43-3
Created by admin on Sat Dec 16 12:35:22 GMT 2023 , Edited by admin on Sat Dec 16 12:35:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID30198989
Created by admin on Sat Dec 16 12:35:22 GMT 2023 , Edited by admin on Sat Dec 16 12:35:22 GMT 2023
PRIMARY
PUBCHEM
3016582
Created by admin on Sat Dec 16 12:35:22 GMT 2023 , Edited by admin on Sat Dec 16 12:35:22 GMT 2023
PRIMARY
FDA UNII
BO5VQM4V2C
Created by admin on Sat Dec 16 12:35:22 GMT 2023 , Edited by admin on Sat Dec 16 12:35:22 GMT 2023
PRIMARY