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14094-12-3 | Propane, 2-methyl-2-(methylsulfonyl)-
CAS No: 14094-12-3 Catalog No: AG001FNX MDL No:
Product Description
Catalog Number:
AG001FNX
Chemical Name:
Propane, 2-methyl-2-(methylsulfonyl)-
CAS Number:
14094-12-3
Molecular Formula:
C5H12O2S
Molecular Weight:
136.2126
IUPAC Name:
2-methyl-2-methylsulfonylpropane
InChI:
InChI=1S/C5H12O2S/c1-5(2,3)8(4,6)7/h1-4H3
InChI Key:
HLEIMSOLPXIGIS-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)C(C)(C)C
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.056g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.209g/mol
Monoisotopic Mass:
136.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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