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113568-19-7 | L-Alanine, N,N-bis[(1,1-dimethylethoxy)carbonyl]-
CAS No: 113568-19-7 Catalog No: AG00090H MDL No:
Product Description
Catalog Number:
AG00090H
Chemical Name:
L-Alanine, N,N-bis[(1,1-dimethylethoxy)carbonyl]-
CAS Number:
113568-19-7
Molecular Formula:
C13H23NO6
Molecular Weight:
289.3248
IUPAC Name:
(2S)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
InChI:
InChI=1S/C13H23NO6/c1-8(9(15)16)14(10(17)19-12(2,3)4)11(18)20-13(5,6)7/h8H,1-7H3,(H,15,16)/t8-/m0/s1
InChI Key:
XMIVRIIWHXNEPS-QMMMGPOBSA-N
SMILES:
C[C@H](N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
289.153g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.328g/mol
Monoisotopic Mass:
289.153g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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