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101726-89-0 | 2-Naphthalenesulfonyl chloride, 6-[(phenylsulfonyl)oxy]-
CAS No: 101726-89-0 Catalog No: AG0005BP MDL No:
Product Description
Catalog Number:
AG0005BP
Chemical Name:
2-Naphthalenesulfonyl chloride, 6-[(phenylsulfonyl)oxy]-
CAS Number:
101726-89-0
Molecular Formula:
C16H11ClO5S2
Molecular Weight:
382.8385
IUPAC Name:
(6-chlorosulfonylnaphthalen-2-yl) benzenesulfonate
InChI:
InChI=1S/C16H11ClO5S2/c17-23(18,19)16-9-7-12-10-14(8-6-13(12)11-16)22-24(20,21)15-4-2-1-3-5-15/h1-11H
InChI Key:
PUNJCNGVAZNDDT-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)Oc1ccc2c(c1)ccc(c2)S(=O)(=O)Cl
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.974g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.829g/mol
Monoisotopic Mass:
381.974g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
94.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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