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Details

Stereochemistry RACEMIC
Molecular Formula C12H17NO2
Molecular Weight 207.2689
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 3-(benzylamino)-2-methylpropanoate

SMILES

COC(=O)C(C)CNCC1=CC=CC=C1

InChI

InChIKey=AMFQVMBTZNGVDU-UHFFFAOYSA-N
InChI=1S/C12H17NO2/c1-10(12(14)15-2)8-13-9-11-6-4-3-5-7-11/h3-7,10,13H,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H17NO2
Molecular Weight 207.2689
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:56:37 GMT 2025
Edited
by admin
on Wed Apr 02 20:56:37 GMT 2025
Record UNII
55TQG9KHN6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 3-(benzylamino)-2-methylpropanoate
Systematic Name English
Methyl 2-methyl-3-[(phenylmethyl)amino]propanoate
Preferred Name English
Propanoic acid, 2-methyl-3-[(phenylmethyl)amino]-, methyl ester
Systematic Name English
Code System Code Type Description
CAS
4010-62-2
Created by admin on Wed Apr 02 20:56:37 GMT 2025 , Edited by admin on Wed Apr 02 20:56:37 GMT 2025
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PUBCHEM
97781
Created by admin on Wed Apr 02 20:56:37 GMT 2025 , Edited by admin on Wed Apr 02 20:56:37 GMT 2025
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FDA UNII
55TQG9KHN6
Created by admin on Wed Apr 02 20:56:37 GMT 2025 , Edited by admin on Wed Apr 02 20:56:37 GMT 2025
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EPA CompTox
DTXSID701233691
Created by admin on Wed Apr 02 20:56:37 GMT 2025 , Edited by admin on Wed Apr 02 20:56:37 GMT 2025
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