Home Other Building Blocks 4-Acetamidobenzenesulfinic acid

4-Acetamidobenzenesulfinic acid

CAS No.:
710-24-7
Catalog Number:
AG003KM7
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
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Product Description
Catalog Number:
AG003KM7
Chemical Name:
4-Acetamidobenzenesulfinic acid
CAS Number:
710-24-7
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
MDL Number:
MFCD00020213
IUPAC Name:
4-acetamidobenzenesulfinic acid
InChI:
InChI=1S/C8H9NO3S/c1-6(10)9-7-2-4-8(5-3-7)13(11)12/h2-5H,1H3,(H,9,10)(H,11,12)
InChI Key:
YDQNDKBOOVXRTL-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)S(=O)O
Properties
Complexity:
211  
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:
4  
Hydrogen Bond Donor Count:
2  
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:
0.8  
Properties