Home Sulfos 3-methanesulfonylbenzamide

3-methanesulfonylbenzamide

CAS No.:
22821-73-4
Catalog Number:
AG01AK1L
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
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Product Description
Catalog Number:
AG01AK1L
Chemical Name:
3-methanesulfonylbenzamide
CAS Number:
22821-73-4
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
MDL Number:
MFCD11643172
IUPAC Name:
3-methylsulfonylbenzamide
InChI:
InChI=1S/C8H9NO3S/c1-13(11,12)7-4-2-3-6(5-7)8(9)10/h2-5H,1H3,(H2,9,10)
InChI Key:
JUXCNQXIDVEUAE-UHFFFAOYSA-N
SMILES:
NC(=O)c1cccc(c1)S(=O)(=O)C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.224g/mol
Monoisotopic Mass:
199.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties