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141642-41-3 | Cyclopentanol, 3-(phenylsulfonyl)-, methanesulfonate, cis- (9CI)
CAS No: 141642-41-3 Catalog No: AG001GRV MDL No:
Product Description
Catalog Number:
AG001GRV
Chemical Name:
Cyclopentanol, 3-(phenylsulfonyl)-, methanesulfonate, cis- (9CI)
CAS Number:
141642-41-3
Molecular Formula:
C12H16O5S2
Molecular Weight:
304.3824
IUPAC Name:
3-(benzenesulfonyl)cyclopentan-1-ol;methanesulfonic acid
InChI:
InChI=1S/C11H14O3S.CH4O3S/c12-9-6-7-11(8-9)15(13,14)10-4-2-1-3-5-10;1-5(2,3)4/h1-5,9,11-12H,6-8H2;1H3,(H,2,3,4)
InChI Key:
HWDYCRSQERJTFK-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)O[C@H]1CC[C@H](C1)S(=O)(=O)c1ccccc1
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.054g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
322.39g/mol
Monoisotopic Mass:
322.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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