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119005-25-3 | 2-Azetidinone, 4-(2-naphthalenylsulfonyl)-
CAS No: 119005-25-3 Catalog No: AG000P15 MDL No:
Product Description
Catalog Number:
AG000P15
Chemical Name:
2-Azetidinone, 4-(2-naphthalenylsulfonyl)-
CAS Number:
119005-25-3
Molecular Formula:
C13H11NO3S
Molecular Weight:
261.2963
IUPAC Name:
4-naphthalen-2-ylsulfonylazetidin-2-one
InChI:
InChI=1S/C13H11NO3S/c15-12-8-13(14-12)18(16,17)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H,8H2,(H,14,15)
InChI Key:
PUIDKDXLOJKTOP-UHFFFAOYSA-N
SMILES:
O=C1CC(N1)S(=O)(=O)c1ccc2c(c1)cccc2
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.295g/mol
Monoisotopic Mass:
261.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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