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Details

Stereochemistry ACHIRAL
Molecular Formula C12H11ClN2O.2ClH
Molecular Weight 307.603
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Chloro-4-(pyridin-3-ylmethoxy)aniline dihydrochloride

SMILES

Cl.Cl.NC1=CC=C(OCC2=CN=CC=C2)C(Cl)=C1

InChI

InChIKey=VMKJLXNSLKSOSN-UHFFFAOYSA-N
InChI=1S/C12H11ClN2O.2ClH/c13-11-6-10(14)3-4-12(11)16-8-9-2-1-5-15-7-9;;/h1-7H,8,14H2;2*1H

HIDE SMILES / InChI

Molecular Formula C12H11ClN2O
Molecular Weight 234.682
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 Wed Apr 02 19:21:53 GMT 2025
Edited
by admin
on Wed Apr 02 19:21:53 GMT 2025
Record UNII
FM5SB9BK4H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenamine, 3-chloro-4-(3-pyridinylmethoxy)-, hydrochloride (1:2)
Preferred Name English
3-Chloro-4-(pyridin-3-ylmethoxy)aniline dihydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
FM5SB9BK4H
Created by admin on Wed Apr 02 19:21:53 GMT 2025 , Edited by admin on Wed Apr 02 19:21:53 GMT 2025
PRIMARY
PUBCHEM
42937475
Created by admin on Wed Apr 02 19:21:53 GMT 2025 , Edited by admin on Wed Apr 02 19:21:53 GMT 2025
PRIMARY
CAS
1170528-42-3
Created by admin on Wed Apr 02 19:21:53 GMT 2025 , Edited by admin on Wed Apr 02 19:21:53 GMT 2025
PRIMARY
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