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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H15NO4
Molecular Weight 189.209
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-Aspartic acid 4-tert-butyl ester

SMILES

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

InChI

InChIKey=MXWMFBYWXMXRPD-YFKPBYRVSA-N
InChI=1S/C8H15NO4/c1-8(2,3)13-6(10)4-5(9)7(11)12/h5H,4,9H2,1-3H3,(H,11,12)/t5-/m0/s1

HIDE SMILES / InChI

Molecular Formula C8H15NO4
Molecular Weight 189.209
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 Sat Dec 16 19:35:50 GMT 2023
Edited
by admin
on Sat Dec 16 19:35:50 GMT 2023
Record UNII
X9KMG9QTL5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-Aspartic acid 4-tert-butyl ester
Common Name English
L-Aspartic acid, 4-(1,1-dimethylethyl) ester
Common Name English
4-(1,1-Dimethylethyl) hydrogen L-aspartate
Common Name English
(S)-2-Amino-4-tert-butoxy-4-oxobutanoic acid
Systematic Name English
(2S)-2-Amino-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
Systematic Name English
Code System Code Type Description
FDA UNII
X9KMG9QTL5
Created by admin on Sat Dec 16 19:35:50 GMT 2023 , Edited by admin on Sat Dec 16 19:35:50 GMT 2023
PRIMARY
CAS
3057-74-7
Created by admin on Sat Dec 16 19:35:50 GMT 2023 , Edited by admin on Sat Dec 16 19:35:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID40184656
Created by admin on Sat Dec 16 19:35:50 GMT 2023 , Edited by admin on Sat Dec 16 19:35:50 GMT 2023
PRIMARY
PUBCHEM
7010569
Created by admin on Sat Dec 16 19:35:50 GMT 2023 , Edited by admin on Sat Dec 16 19:35:50 GMT 2023
PRIMARY
Related Record Type Details
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