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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H12N2O2
Molecular Weight 180.2038
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[[3-(Aminomethyl)phenyl]methyl]carbamic acid

SMILES

NCC1=CC=CC(CNC(O)=O)=C1

InChI

InChIKey=HYKFCGUBCWWEBA-UHFFFAOYSA-N
InChI=1S/C9H12N2O2/c10-5-7-2-1-3-8(4-7)6-11-9(12)13/h1-4,11H,5-6,10H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C9H12N2O2
Molecular Weight 180.2038
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 20:02:24 GMT 2023
Edited
by admin
on Sat Dec 16 20:02:24 GMT 2023
Record UNII
JY6MTU82RX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[[3-(Aminomethyl)phenyl]methyl]carbamic acid
Systematic Name English
Carbamic acid, N-[[3-(aminomethyl)phenyl]methyl]-
Systematic Name English
Carbamic acid, [[3-(aminomethyl)phenyl]methyl]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
257-767-1
Created by admin on Sat Dec 16 20:02:24 GMT 2023 , Edited by admin on Sat Dec 16 20:02:24 GMT 2023
PRIMARY
FDA UNII
JY6MTU82RX
Created by admin on Sat Dec 16 20:02:24 GMT 2023 , Edited by admin on Sat Dec 16 20:02:24 GMT 2023
PRIMARY
PUBCHEM
104129
Created by admin on Sat Dec 16 20:02:24 GMT 2023 , Edited by admin on Sat Dec 16 20:02:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID6068721
Created by admin on Sat Dec 16 20:02:24 GMT 2023 , Edited by admin on Sat Dec 16 20:02:24 GMT 2023
PRIMARY
CAS
52235-55-9
Created by admin on Sat Dec 16 20:02:24 GMT 2023 , Edited by admin on Sat Dec 16 20:02:24 GMT 2023
PRIMARY