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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19NO3
Molecular Weight 237.2949
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl (2S)-2-amino-2-[4-(tert-butoxy)phenyl]acetate

SMILES

COC(=O)[C@@H](N)C1=CC=C(OC(C)(C)C)C=C1

InChI

InChIKey=HKOCBGCNPVEYCO-NSHDSACASA-N
InChI=1S/C13H19NO3/c1-13(2,3)17-10-7-5-9(6-8-10)11(14)12(15)16-4/h5-8,11H,14H2,1-4H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19NO3
Molecular Weight 237.2949
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:42:10 GMT 2025
Edited
by admin
on Wed Apr 02 19:42:10 GMT 2025
Record UNII
V6JSS36ETK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl (2S)-2-amino-2-[4-(tert-butoxy)phenyl]acetate
Systematic Name English
Benzeneacetic acid, ?-amino-4-(1,1-dimethylethoxy)-, methyl ester, (?S)-
Preferred Name English
Methyl (?S)-?-amino-4-(1,1-dimethylethoxy)benzeneacetate
Systematic Name English
Code System Code Type Description
PUBCHEM
171214843
Created by admin on Wed Apr 02 19:42:10 GMT 2025 , Edited by admin on Wed Apr 02 19:42:10 GMT 2025
PRIMARY
FDA UNII
V6JSS36ETK
Created by admin on Wed Apr 02 19:42:10 GMT 2025 , Edited by admin on Wed Apr 02 19:42:10 GMT 2025
PRIMARY
CAS
2281859-72-9
Created by admin on Wed Apr 02 19:42:10 GMT 2025 , Edited by admin on Wed Apr 02 19:42:10 GMT 2025
PRIMARY
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