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24892-96-4 | Benzenesulfonyl fluoride, 4-[4-(2-chloro-4-nitrophenyl)-1,3-butadien-1-yl]-
CAS No: 24892-96-4 Catalog No: AG002PRK MDL No:
Product Description
Catalog Number:
AG002PRK
Chemical Name:
Benzenesulfonyl fluoride, 4-[4-(2-chloro-4-nitrophenyl)-1,3-butadien-1-yl]-
CAS Number:
24892-96-4
Molecular Formula:
C16H11ClFNO4S
Molecular Weight:
367.7792
IUPAC Name:
4-[4-(2-chloro-4-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
InChI:
InChI=1S/C16H11ClFNO4S/c17-16-11-14(19(20)21)8-7-13(16)4-2-1-3-12-5-9-15(10-6-12)24(18,22)23/h1-11H
InChI Key:
LNHBCOQQQBFIJA-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1C=CC=Cc1ccc(cc1)S(=O)(=O)F)[N+](=O)[O-]
Properties
Complexity:
588
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.008g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.775g/mol
Monoisotopic Mass:
367.008g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.1
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