200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1791-13-5
1791-13-5 | L-Aspartic acid, 1,4-bis(1,1-dimethylethyl) ester, hydrochloride (1:1)
CAS No: 1791-13-5 Catalog No: AG0026SI MDL No:MFCD00034851
Product Description
Catalog Number:
AG0026SI
Chemical Name:
L-Aspartic acid, 1,4-bis(1,1-dimethylethyl) ester, hydrochloride (1:1)
CAS Number:
1791-13-5
Molecular Formula:
C12H24ClNO4
Molecular Weight:
281.7763
MDL Number:
MFCD00034851
IUPAC Name:
ditert-butyl (2S)-2-aminobutanedioate;hydrochloride
InChI:
InChI=1S/C12H23NO4.ClH/c1-11(2,3)16-9(14)7-8(13)10(15)17-12(4,5)6;/h8H,7,13H2,1-6H3;1H/t8-;/m0./s1
InChI Key:
GVLZIMQSYQDAHB-QRPNPIFTSA-N
SMILES:
O=C(OC(C)(C)C)C[C@@H](C(=O)OC(C)(C)C)N.Cl
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
281.139g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.777g/mol
Monoisotopic Mass:
281.139g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.