Home Halogens 3-(chloromethyl)-1lambda6-thiane-1,1-dione

3-(chloromethyl)-1lambda6-thiane-1,1-dione

CAS No.:
1481109-28-7
Catalog Number:
AG01B9DF
Molecular Formula:
C6H11ClO2S
Molecular Weight:
182.6683
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Product Description
Catalog Number:
AG01B9DF
Chemical Name:
3-(chloromethyl)-1lambda6-thiane-1,1-dione
CAS Number:
1481109-28-7
Molecular Formula:
C6H11ClO2S
Molecular Weight:
182.6683
MDL Number:
MFCD21081233
IUPAC Name:
3-(chloromethyl)thiane 1,1-dioxide
InChI:
InChI=1S/C6H11ClO2S/c7-4-6-2-1-3-10(8,9)5-6/h6H,1-5H2
InChI Key:
QQJVSMPQCSJRTE-UHFFFAOYSA-N
SMILES:
ClCC1CCCS(=O)(=O)C1
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.017g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.662g/mol
Monoisotopic Mass:
182.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties