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15804-29-2 | Sulfamoyl isocyanate
CAS No: 15804-29-2 Catalog No: AG001PXL MDL No:
Product Description
Catalog Number:
AG001PXL
Chemical Name:
Sulfamoyl isocyanate
CAS Number:
15804-29-2
Molecular Formula:
CH2N2O3S
Molecular Weight:
122.1032
IUPAC Name:
sulfamoyl isocyanate
InChI:
InChI=1S/CH2N2O3S/c2-7(5,6)3-1-4/h(H2,2,5,6)
InChI Key:
FOKNEOPXGZGGBW-UHFFFAOYSA-N
SMILES:
O=C=NS(=O)(=O)N
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.979g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
122.098g/mol
Monoisotopic Mass:
121.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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