Home Aminos Butanoic acid, 4-amino-3,3-dimethyl-

Butanoic acid, 4-amino-3,3-dimethyl-

CAS No.:
89584-22-5
Catalog Number:
AG0086H8
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
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Product Description
Catalog Number:
AG0086H8
Chemical Name:
Butanoic acid, 4-amino-3,3-dimethyl-
CAS Number:
89584-22-5
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
MDL Number:
MFCD01087495
IUPAC Name:
4-amino-3,3-dimethylbutanoic acid
InChI:
InChI=1S/C6H13NO2/c1-6(2,4-7)3-5(8)9/h3-4,7H2,1-2H3,(H,8,9)
InChI Key:
BDEGNHSSXDSZRQ-UHFFFAOYSA-N
SMILES:
NCC(CC(=O)O)(C)C
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.095g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
131.175g/mol
Monoisotopic Mass:
131.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3  
Literature
Title Journal
Cephalosporin prodrugs of paclitaxel for immunologically specific activation by L-49-sFv-beta-lactamase fusion protein. Bioorganic & medicinal chemistry letters 20030210
Properties