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89555-97-5 | Cyclooctanesulfonyl chloride, 4-(trichloromethyl)-
CAS No: 89555-97-5 Catalog No: AG003YCQ MDL No:
Product Description
Catalog Number:
AG003YCQ
Chemical Name:
Cyclooctanesulfonyl chloride, 4-(trichloromethyl)-
CAS Number:
89555-97-5
Molecular Formula:
C9H14Cl4O2S
Molecular Weight:
328.0833
IUPAC Name:
4-(trichloromethyl)cyclooctane-1-sulfonyl chloride
InChI:
InChI=1S/C9H14Cl4O2S/c10-9(11,12)7-3-1-2-4-8(6-5-7)16(13,14)15/h7-8H,1-6H2
InChI Key:
IJXUTKYFHWYCOT-UHFFFAOYSA-N
SMILES:
ClC(C1CCCCC(CC1)S(=O)(=O)Cl)(Cl)Cl
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.944g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.069g/mol
Monoisotopic Mass:
325.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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