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16066-31-2 | Benzenesulfinamide
CAS No: 16066-31-2 Catalog No: AG001S3O MDL No:MFCD00465093
Product Description
Catalog Number:
AG001S3O
Chemical Name:
Benzenesulfinamide
CAS Number:
16066-31-2
Molecular Formula:
C6H7NOS
Molecular Weight:
141.1909
MDL Number:
MFCD00465093
IUPAC Name:
benzenesulfinamide
InChI:
InChI=1S/C6H7NOS/c7-9(8)6-4-2-1-3-5-6/h1-5H,7H2
InChI Key:
QJCPEOFEBREKQB-UHFFFAOYSA-N
SMILES:
NS(=O)c1ccccc1
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.188g/mol
Monoisotopic Mass:
141.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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