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114288-74-3 | 1,3-Oxathiane, 5,6-dimethyl-
CAS No: 114288-74-3 Catalog No: AG000AZR MDL No:
Product Description
Catalog Number:
AG000AZR
Chemical Name:
1,3-Oxathiane, 5,6-dimethyl-
CAS Number:
114288-74-3
Molecular Formula:
C6H12OS
Molecular Weight:
132.2239
IUPAC Name:
5,6-dimethyl-1,3-oxathiane
InChI:
InChI=1S/C6H12OS/c1-5-3-8-4-7-6(5)2/h5-6H,3-4H2,1-2H3
InChI Key:
DWBIQJMCLXSPSZ-UHFFFAOYSA-N
SMILES:
CC1OCSCC1C
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.061g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.221g/mol
Monoisotopic Mass:
132.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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