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79032-43-2 | Acetamide, N-[4-hydroxy-3-(methylsulfinyl)phenyl]-
CAS No: 79032-43-2 Catalog No: AG0054H2 MDL No:
Product Description
Catalog Number:
AG0054H2
Chemical Name:
Acetamide, N-[4-hydroxy-3-(methylsulfinyl)phenyl]-
CAS Number:
79032-43-2
Molecular Formula:
C9H11NO3S
Molecular Weight:
213.2535
IUPAC Name:
N-(4-hydroxy-3-methylsulfinylphenyl)acetamide
InChI:
InChI=1S/C9H11NO3S/c1-6(11)10-7-3-4-8(12)9(5-7)14(2)13/h3-5,12H,1-2H3,(H,10,11)
InChI Key:
VZJAYBKNOKZSRA-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c(c1)S(=O)C)O
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.251g/mol
Monoisotopic Mass:
213.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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