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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H24N2O4.ClH
Molecular Weight 296.791
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-AMINO-N-(TERT-BUTOXYCARBONYL)-L-ALANINE TERT-BUTYL ESTER HYDROCHLORIDE

SMILES

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

InChI

InChIKey=NNVLQCWVLLOZNV-QRPNPIFTSA-N
InChI=1S/C12H24N2O4.ClH/c1-11(2,3)17-9(15)8(7-13)14-10(16)18-12(4,5)6;/h8H,7,13H2,1-6H3,(H,14,16);1H/t8-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C12H24N2O4
Molecular Weight 260.33
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 Sat Dec 16 18:22:38 GMT 2023
Edited
by admin
on Sat Dec 16 18:22:38 GMT 2023
Record UNII
N6DQZ7F2WF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-AMINO-N-(TERT-BUTOXYCARBONYL)-L-ALANINE TERT-BUTYL ESTER HYDROCHLORIDE
Systematic Name English
L-ALANINE, 3-AMINO-N-((1,1-DIMETHYLETHOXY)CARBONYL)-, 1,1-DIMETHYLETHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
BOC-L-DAP-OTBU HYDROCHLORIDE
Common Name English
Code System Code Type Description
FDA UNII
N6DQZ7F2WF
Created by admin on Sat Dec 16 18:22:39 GMT 2023 , Edited by admin on Sat Dec 16 18:22:39 GMT 2023
PRIMARY
PUBCHEM
86679032
Created by admin on Sat Dec 16 18:22:39 GMT 2023 , Edited by admin on Sat Dec 16 18:22:39 GMT 2023
PRIMARY
CAS
1333246-31-3
Created by admin on Sat Dec 16 18:22:39 GMT 2023 , Edited by admin on Sat Dec 16 18:22:39 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE