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Home > Sulfanilamide > 1216981-05-3
1216981-05-3 | N-{[1-(hydroxymethyl)cyclohexyl]methyl}-4-methylbenzene-1-sulfonamide
CAS No: 1216981-05-3 Catalog No: AG01A5G6 MDL No:MFCD14877365
Product Description
Catalog Number:
AG01A5G6
Chemical Name:
N-{[1-(hydroxymethyl)cyclohexyl]methyl}-4-methylbenzene-1-sulfonamide
CAS Number:
1216981-05-3
Molecular Formula:
C15H23NO3S
Molecular Weight:
297.4130
MDL Number:
MFCD14877365
IUPAC Name:
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C15H23NO3S/c1-13-5-7-14(8-6-13)20(18,19)16-11-15(12-17)9-3-2-4-10-15/h5-8,16-17H,2-4,9-12H2,1H3
InChI Key:
ZLKIQAPHVFSBFO-UHFFFAOYSA-N
SMILES:
OCC1(CCCCC1)CNS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.14g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.413g/mol
Monoisotopic Mass:
297.14g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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