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114092-82-9 | Cyclobutanol, 2-(phenylsulfonyl)-, trans- (9CI)
CAS No: 114092-82-9 Catalog No: AG000AJN MDL No:
Product Description
Catalog Number:
AG000AJN
Chemical Name:
Cyclobutanol, 2-(phenylsulfonyl)-, trans- (9CI)
CAS Number:
114092-82-9
Molecular Formula:
C10H12O3S
Molecular Weight:
212.2655
IUPAC Name:
2-(benzenesulfonyl)cyclobutan-1-ol
InChI:
InChI=1S/C10H12O3S/c11-9-6-7-10(9)14(12,13)8-4-2-1-3-5-8/h1-5,9-11H,6-7H2
InChI Key:
GJSGNRDPANMFBM-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@H]1S(=O)(=O)c1ccccc1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.263g/mol
Monoisotopic Mass:
212.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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