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141597-48-0 | L-Norvaline, 5-chloro-N-[(1,1-dimethylethoxy)carbonyl]-4-oxo-, methyl ester
CAS No: 141597-48-0 Catalog No: AG001GNI MDL No:
Product Description
Catalog Number:
AG001GNI
Chemical Name:
L-Norvaline, 5-chloro-N-[(1,1-dimethylethoxy)carbonyl]-4-oxo-, methyl ester
CAS Number:
141597-48-0
Molecular Formula:
C11H18ClNO5
Molecular Weight:
279.7173
IUPAC Name:
methyl (2S)-5-chloro-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoate
InChI:
InChI=1S/C11H18ClNO5/c1-11(2,3)18-10(16)13-8(9(15)17-4)5-7(14)6-12/h8H,5-6H2,1-4H3,(H,13,16)/t8-/m0/s1
InChI Key:
WAYGRXHRWZVBEY-QMMMGPOBSA-N
SMILES:
ClCC(=O)C[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
279.087g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.717g/mol
Monoisotopic Mass:
279.087g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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