Home Other Building Blocks 1,1-diethoxy-2-methanesulfinylethane

1,1-diethoxy-2-methanesulfinylethane

CAS No.:
1344048-22-1
Catalog Number:
AG01DVVT
Molecular Formula:
C7H16O3S
Molecular Weight:
180.2651
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Product Description
Catalog Number:
AG01DVVT
Chemical Name:
1,1-diethoxy-2-methanesulfinylethane
CAS Number:
1344048-22-1
Molecular Formula:
C7H16O3S
Molecular Weight:
180.2651
MDL Number:
MFCD20378510
IUPAC Name:
1,1-diethoxy-2-methylsulfinylethane
InChI:
InChI=1S/C7H16O3S/c1-4-9-7(10-5-2)6-11(3)8/h7H,4-6H2,1-3H3
InChI Key:
XCTUBEXTFKGDFL-UHFFFAOYSA-N
SMILES:
CCOC(CS(=O)C)OCC
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.082g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.262g/mol
Monoisotopic Mass:
180.082g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties