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145730-98-9 | Butanoic acid, 2-[(2-naphthalenylsulfonyl)amino]-
CAS No: 145730-98-9 Catalog No: AG001DC9 MDL No:MFCD01873084
Product Description
Catalog Number:
AG001DC9
Chemical Name:
Butanoic acid, 2-[(2-naphthalenylsulfonyl)amino]-
CAS Number:
145730-98-9
Molecular Formula:
C14H15NO4S
Molecular Weight:
293.3382
MDL Number:
MFCD01873084
IUPAC Name:
2-(naphthalen-2-ylsulfonylamino)butanoic acid
InChI:
InChI=1S/C14H15NO4S/c1-2-13(14(16)17)15-20(18,19)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,13,15H,2H2,1H3,(H,16,17)
InChI Key:
JHMNSCZBIJSNRA-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)NS(=O)(=O)c1ccc2c(c1)cccc2
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.072g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.337g/mol
Monoisotopic Mass:
293.072g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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