Home Sulfos isocyanato(methanesulfonyl)methane

isocyanato(methanesulfonyl)methane

CAS No.:
1161826-12-5
Catalog Number:
AG01BD5P
Molecular Formula:
C3H5NO3S
Molecular Weight:
135.1417
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Product Description
Catalog Number:
AG01BD5P
Chemical Name:
isocyanato(methanesulfonyl)methane
CAS Number:
1161826-12-5
Molecular Formula:
C3H5NO3S
Molecular Weight:
135.1417
MDL Number:
MFCD19632225
IUPAC Name:
isocyanato(methylsulfonyl)methane
InChI:
InChI=1S/C3H5NO3S/c1-8(6,7)3-4-2-5/h3H2,1H3
InChI Key:
KLBXRKHTNWQTNR-UHFFFAOYSA-N
SMILES:
O=C=NCS(=O)(=O)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.999g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.137g/mol
Monoisotopic Mass:
134.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties