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182227-17-4 | D-Valine, N-(2-naphthalenylsulfonyl)-
CAS No: 182227-17-4 Catalog No: AG0023HS MDL No:
Product Description
Catalog Number:
AG0023HS
Chemical Name:
D-Valine, N-(2-naphthalenylsulfonyl)-
CAS Number:
182227-17-4
Molecular Formula:
C15H17NO4S
Molecular Weight:
307.3648
IUPAC Name:
(2R)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
InChI:
InChI=1S/C15H17NO4S/c1-10(2)14(15(17)18)16-21(19,20)13-8-7-11-5-3-4-6-12(11)9-13/h3-10,14,16H,1-2H3,(H,17,18)/t14-/m1/s1
InChI Key:
GFCPZHIUZCLSNZ-CQSZACIVSA-N
SMILES:
CC([C@H](C(=O)O)NS(=O)(=O)c1ccc2c(c1)cccc2)C
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
307.088g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
307.364g/mol
Monoisotopic Mass:
307.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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