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89729-98-6 | Cyclopentanone, 2-(propylsulfonyl)-
CAS No: 89729-98-6 Catalog No: AG0041Y1 MDL No:MFCD20377456
Product Description
Catalog Number:
AG0041Y1
Chemical Name:
Cyclopentanone, 2-(propylsulfonyl)-
CAS Number:
89729-98-6
Molecular Formula:
C8H14O3S
Molecular Weight:
190.2600
MDL Number:
MFCD20377456
IUPAC Name:
2-propylsulfonylcyclopentan-1-one
InChI:
InChI=1S/C8H14O3S/c1-2-6-12(10,11)8-5-3-4-7(8)9/h8H,2-6H2,1H3
InChI Key:
AOLFASJQCJOSPV-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)C1CCCC1=O
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.066g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.257g/mol
Monoisotopic Mass:
190.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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