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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClO2
Molecular Weight 170.593
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 3-CHLOROBENZOATE

SMILES

COC(=O)C1=CC=CC(Cl)=C1

InChI

InChIKey=XRDRKVPNHIWTBX-UHFFFAOYSA-N
InChI=1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7ClO2
Molecular Weight 170.593
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 20:32:39 GMT 2023
Edited
by admin
on Fri Dec 15 20:32:39 GMT 2023
Record UNII
9M3K1L0149
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 3-CHLOROBENZOATE
Systematic Name English
M-CHLOROBENZOIC ACID METHYL ESTER
Systematic Name English
BENZOIC ACID, 3-CHLORO-, METHYL ESTER
Systematic Name English
3-(METHOXYCARBONYL)PHENYL CHLORIDE
Systematic Name English
BENZOIC ACID, M-CHLORO-, METHYL ESTER
Common Name English
METHYL M-CHLOROBENZOATE
Systematic Name English
3-CHLOROBENZOIC ACID METHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID6027507
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
220-814-1
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY
HSDB
5465
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY
PUBCHEM
17946
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY
FDA UNII
9M3K1L0149
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY
CAS
2905-65-9
Created by admin on Fri Dec 15 20:32:40 GMT 2023 , Edited by admin on Fri Dec 15 20:32:40 GMT 2023
PRIMARY