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88486-43-5 | Benzene, [(2-chloro-1-octenyl)sulfonyl]-
CAS No: 88486-43-5 Catalog No: AG0049HN MDL No:
Product Description
Catalog Number:
AG0049HN
Chemical Name:
Benzene, [(2-chloro-1-octenyl)sulfonyl]-
CAS Number:
88486-43-5
Molecular Formula:
C14H19ClO2S
Molecular Weight:
286.8175
IUPAC Name:
2-chlorooct-1-enylsulfonylbenzene
InChI:
InChI=1S/C14H19ClO2S/c1-2-3-4-6-9-13(15)12-18(16,17)14-10-7-5-8-11-14/h5,7-8,10-12H,2-4,6,9H2,1H3
InChI Key:
PHZSQTYYPKZRNF-UHFFFAOYSA-N
SMILES:
CCCCCCC(=CS(=O)(=O)c1ccccc1)Cl
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.814g/mol
Monoisotopic Mass:
286.079g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.7
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