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10181-73-4 | Benzene, (cyclopentylsulfinyl)-
CAS No: 10181-73-4 Catalog No: AG0005MD MDL No:
Product Description
Catalog Number:
AG0005MD
Chemical Name:
Benzene, (cyclopentylsulfinyl)-
CAS Number:
10181-73-4
Molecular Formula:
C11H14OS
Molecular Weight:
194.2933
IUPAC Name:
cyclopentylsulfinylbenzene
InChI:
InChI=1S/C11H14OS/c12-13(11-8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChI Key:
MKKIBJKGTCQHGQ-UHFFFAOYSA-N
SMILES:
O=S(c1ccccc1)C1CCCC1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.292g/mol
Monoisotopic Mass:
194.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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