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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClO
Molecular Weight 154.594
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLBENZOYL CHLORIDE

SMILES

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

InChI

InChIKey=NQUVCRCCRXRJCK-UHFFFAOYSA-N
InChI=1S/C8H7ClO/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7ClO
Molecular Weight 154.594
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
2-(4-tert-Butyl-phen-yl)-5-p-tolyl-1,3,4-oxadiazole.
2009-12-04
2-{3,4-Dibut-oxy-5-[5-(3-methyl-phen-yl)-1,3,4-oxadiazol-2-yl]thio-phen-2-yl}-5-(3-methyl-phen-yl)-1,3,4-oxadiazole.
2009-02-28
Methyl 4-(4-methyl-benzamido)-2-sulfamoylbenzoate.
2008-11-08
Synthesis of 5- and 6-carboxy-X-rhodamines.
2008-11-06
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:28:12 GMT 2025
Edited
by admin
on Mon Mar 31 19:28:12 GMT 2025
Record UNII
092E36PWL4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-METHYLBENZOYL CHLORIDE
Preferred Name English
4-METHYLBENZOYL CHLORIDE
Systematic Name English
4-METHYLBENZOIC ACID CHLORIDE
Systematic Name English
4-METHYLBENZENECARBONYL CHLORIDE
Systematic Name English
BENZOYL CHLORIDE, 4-METHYL-
Systematic Name English
P-TOLUOYL CHLORIDE
Common Name English
P-TOLUIC ACID CHLORIDE
Common Name English
4-TOLUOYL CHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
13405
Created by admin on Mon Mar 31 19:28:12 GMT 2025 , Edited by admin on Mon Mar 31 19:28:12 GMT 2025
PRIMARY
CAS
874-60-2
Created by admin on Mon Mar 31 19:28:12 GMT 2025 , Edited by admin on Mon Mar 31 19:28:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID5052595
Created by admin on Mon Mar 31 19:28:12 GMT 2025 , Edited by admin on Mon Mar 31 19:28:12 GMT 2025
PRIMARY
ECHA (EC/EINECS)
212-864-8
Created by admin on Mon Mar 31 19:28:12 GMT 2025 , Edited by admin on Mon Mar 31 19:28:12 GMT 2025
PRIMARY
FDA UNII
092E36PWL4
Created by admin on Mon Mar 31 19:28:12 GMT 2025 , Edited by admin on Mon Mar 31 19:28:12 GMT 2025
PRIMARY