U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H7N.ClH
Molecular Weight 153.609
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHYNYLANILINE HYDROCHLORIDE

SMILES

Cl.NC1=CC(=CC=C1)C#C

InChI

InChIKey=CUNYDQJCQAWKLK-UHFFFAOYSA-N
InChI=1S/C8H7N.ClH/c1-2-7-4-3-5-8(9)6-7;/h1,3-6H,9H2;1H

HIDE SMILES / InChI

Approval Year

Name Type Language
3-ETHYNYLANILINE HYDROCHLORIDE
Common Name English
BENZENAMINE, 3-ETHYNYL-, HYDROCHLORIDE
Preferred Name English
BENZENAMINE, 3-ETHYNYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70596526
Created by admin on Wed Apr 02 02:49:12 GMT 2025 , Edited by admin on Wed Apr 02 02:49:12 GMT 2025
PRIMARY
FDA UNII
N854PSB3VU
Created by admin on Wed Apr 02 02:49:12 GMT 2025 , Edited by admin on Wed Apr 02 02:49:12 GMT 2025
PRIMARY
PUBCHEM
18925023
Created by admin on Wed Apr 02 02:49:12 GMT 2025 , Edited by admin on Wed Apr 02 02:49:12 GMT 2025
PRIMARY
CAS
207226-02-6
Created by admin on Wed Apr 02 02:49:12 GMT 2025 , Edited by admin on Wed Apr 02 02:49:12 GMT 2025
PRIMARY