Home Other Building Blocks 3,3-dimethyl-1,4-oxathiane-2,6-dione

3,3-dimethyl-1,4-oxathiane-2,6-dione

CAS No.:
54772-29-1
Catalog Number:
AG01B98T
Molecular Formula:
C6H8O3S
Molecular Weight:
160.1909
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Product Description
Catalog Number:
AG01B98T
Chemical Name:
3,3-dimethyl-1,4-oxathiane-2,6-dione
CAS Number:
54772-29-1
Molecular Formula:
C6H8O3S
Molecular Weight:
160.1909
MDL Number:
MFCD28348292
IUPAC Name:
3,3-dimethyl-1,4-oxathiane-2,6-dione
InChI:
InChI=1S/C6H8O3S/c1-6(2)5(8)9-4(7)3-10-6/h3H2,1-2H3
InChI Key:
RSWNBRATJQQBEC-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)CSC1(C)C
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.187g/mol
Monoisotopic Mass:
160.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties