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119577-15-0 | 1,3-Oxathiolane, 2-cyclohexyl-2-methyl- (9CI)
CAS No: 119577-15-0 Catalog No: AG000IZ3 MDL No:
Product Description
Catalog Number:
AG000IZ3
Chemical Name:
1,3-Oxathiolane, 2-cyclohexyl-2-methyl- (9CI)
CAS Number:
119577-15-0
Molecular Formula:
C10H18OS
Molecular Weight:
186.3143
IUPAC Name:
2-cyclohexyl-2-methyl-1,3-oxathiolane
InChI:
InChI=1S/C10H18OS/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h9H,2-8H2,1H3
InChI Key:
ZOSYKZSDDGKSGO-UHFFFAOYSA-N
SMILES:
CC1(OCCS1)C1CCCCC1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.108g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.313g/mol
Monoisotopic Mass:
186.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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