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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H12FN3.ClH
Molecular Weight 277.725
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-[(R)-Amino(3-amino-4-fluorophenyl)methyl]benzonitrile hydrochloride

SMILES

Cl.N[C@H](C1=CC=CC(=C1)C#N)C2=CC=C(F)C(N)=C2

InChI

InChIKey=FKBMVOIGKYISBG-PFEQFJNWSA-N
InChI=1S/C14H12FN3.ClH/c15-12-5-4-11(7-13(12)17)14(18)10-3-1-2-9(6-10)8-16;/h1-7,14H,17-18H2;1H/t14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C14H12FN3
Molecular Weight 241.2636
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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 19:08:13 GMT 2025
Edited
by admin
on Wed Apr 02 19:08:13 GMT 2025
Record UNII
EVS9AG6C9R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R)-3-(Amino(3-amino-4-fluorophenyl)methyl)benzonitrile hydrochloride
Preferred Name English
3-[(R)-Amino(3-amino-4-fluorophenyl)methyl]benzonitrile hydrochloride
Systematic Name English
3-(Amino(3-amino-4-fluorophenyl)methyl)benzonitrile hydrochloride, (R)-
Systematic Name English
Benzonitrile, 3-[(R)-amino(3-amino-4-fluorophenyl)methyl]-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
CAS
2602377-06-8
Created by admin on Wed Apr 02 19:08:13 GMT 2025 , Edited by admin on Wed Apr 02 19:08:13 GMT 2025
PRIMARY
PUBCHEM
166437038
Created by admin on Wed Apr 02 19:08:13 GMT 2025 , Edited by admin on Wed Apr 02 19:08:13 GMT 2025
PRIMARY
FDA UNII
EVS9AG6C9R
Created by admin on Wed Apr 02 19:08:13 GMT 2025 , Edited by admin on Wed Apr 02 19:08:13 GMT 2025
PRIMARY
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