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144332-60-5 | Alanine, N,2-dimethyl-N-[(phenylmethoxy)carbonyl]-
CAS No: 144332-60-5 Catalog No: AG001JCF MDL No:MFCD00191898
Product Description
Catalog Number:
AG001JCF
Chemical Name:
Alanine, N,2-dimethyl-N-[(phenylmethoxy)carbonyl]-
CAS Number:
144332-60-5
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
MDL Number:
MFCD00191898
IUPAC Name:
2-methyl-2-[methyl(phenylmethoxycarbonyl)amino]propanoic acid
InChI:
InChI=1S/C13H17NO4/c1-13(2,11(15)16)14(3)12(17)18-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,16)
InChI Key:
QCDSXBNEBTVGTP-UHFFFAOYSA-N
SMILES:
CN(C(C(=O)O)(C)C)C(=O)OCc1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.282g/mol
Monoisotopic Mass:
251.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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