Home Sulfos 3-chlorobutane-1-sulfonyl chloride

3-chlorobutane-1-sulfonyl chloride

CAS No.:
13105-16-3
Catalog Number:
AG01BROO
Molecular Formula:
C4H8Cl2O2S
Molecular Weight:
191.0761
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Product Description
Catalog Number:
AG01BROO
Chemical Name:
3-chlorobutane-1-sulfonyl chloride
CAS Number:
13105-16-3
Molecular Formula:
C4H8Cl2O2S
Molecular Weight:
191.0761
MDL Number:
MFCD19200116
IUPAC Name:
3-chlorobutane-1-sulfonyl chloride
InChI:
InChI=1S/C4H8Cl2O2S/c1-4(5)2-3-9(6,7)8/h4H,2-3H2,1H3
InChI Key:
CXTHSJPWBHRPRW-UHFFFAOYSA-N
SMILES:
CC(CCS(=O)(=O)Cl)Cl
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.962g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.066g/mol
Monoisotopic Mass:
189.962g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties