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84445-74-9 | 2-Propanone, 1-chloro-3-[(4-chlorophenyl)sulfonyl]-
CAS No: 84445-74-9 Catalog No: AG0055NP MDL No:
Product Description
Catalog Number:
AG0055NP
Chemical Name:
2-Propanone, 1-chloro-3-[(4-chlorophenyl)sulfonyl]-
CAS Number:
84445-74-9
Molecular Formula:
C9H8Cl2O3S
Molecular Weight:
267.1290
IUPAC Name:
1-chloro-3-(4-chlorophenyl)sulfonylpropan-2-one
InChI:
InChI=1S/C9H8Cl2O3S/c10-5-8(12)6-15(13,14)9-3-1-7(11)2-4-9/h1-4H,5-6H2
InChI Key:
BMMMGJSOOKKAMF-UHFFFAOYSA-N
SMILES:
ClCC(=O)CS(=O)(=O)c1ccc(cc1)Cl
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.957g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.12g/mol
Monoisotopic Mass:
265.957g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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