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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClNO2
Molecular Weight 185.608
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-amino-4-chlorobenzoate

SMILES

COC(=O)C1=CC=C(Cl)C=C1N

InChI

InChIKey=YPSSCICDVDOEAI-UHFFFAOYSA-N
InChI=1S/C8H8ClNO2/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4H,10H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H8ClNO2
Molecular Weight 185.608
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 13:25:10 GMT 2023
Edited
by admin
on Sat Dec 16 13:25:10 GMT 2023
Record UNII
BWN3H69QRA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 2-amino-4-chlorobenzoate
Systematic Name English
NSC-400871
Code English
4-Chloroanthranilic acid methyl ester
Common Name English
Benzoic acid, 2-amino-4-chloro-, methyl ester
Common Name English
2-Methoxycarbonyl-5-chloroaniline
Systematic Name English
METHYL 4-CHLOROANTHRANILATE
Systematic Name English
2-Amino-4-chlorobenzoic acid methyl ester
Common Name English
Code System Code Type Description
NSC
400871
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY
ECHA (EC/EINECS)
227-593-0
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY
EPA CompTox
DTXSID90207743
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY
CAS
5900-58-3
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY
FDA UNII
BWN3H69QRA
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY
PUBCHEM
80001
Created by admin on Sat Dec 16 13:25:10 GMT 2023 , Edited by admin on Sat Dec 16 13:25:10 GMT 2023
PRIMARY