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Details

Stereochemistry ACHIRAL
Molecular Formula C8H9ClO
Molecular Weight 156.609
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENOL, 2-CHLORO-3,5-DIMETHYL-

SMILES

CC1=CC(C)=C(Cl)C(O)=C1

InChI

InChIKey=ZXPLGLMEXWSLCX-UHFFFAOYSA-N
InChI=1S/C8H9ClO/c1-5-3-6(2)8(9)7(10)4-5/h3-4,10H,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H9ClO
Molecular Weight 156.609
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 18:26:23 UTC 2023
Edited
by admin
on Sat Dec 16 18:26:23 UTC 2023
Record UNII
AM323UDG3U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENOL, 2-CHLORO-3,5-DIMETHYL-
Systematic Name English
2-CHLORO-3,5-DIMETHYLPHENOL
Systematic Name English
3,5-XYLENOL, 2-CHLORO-
Common Name English
CHLOROXYLENOL RELATED COMPOUND A [USP-RS]
Common Name English
2-CHLORO-3,5-XYLENOL
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
226-898-6
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
CAS
5538-41-0
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID5063946
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
PUBCHEM
79667
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
FDA UNII
AM323UDG3U
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
RS_ITEM_NUM
1122722
Created by admin on Sat Dec 16 18:26:23 UTC 2023 , Edited by admin on Sat Dec 16 18:26:23 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (GC)
USP