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113712-86-0 | Acetamide, N-[(4-aminophenyl)sulfonyl]-, compd. with piperidine (1:1) (9CI)
CAS No: 113712-86-0 Catalog No: AG0009FX MDL No:
Product Description
Catalog Number:
AG0009FX
Chemical Name:
Acetamide, N-[(4-aminophenyl)sulfonyl]-, compd. with piperidine (1:1) (9CI)
CAS Number:
113712-86-0
Molecular Formula:
C13H21N3O3S
Molecular Weight:
299.3891
IUPAC Name:
N-(4-aminophenyl)sulfonylacetamide;piperidine
InChI:
InChI=1S/C8H10N2O3S.C5H11N/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8;1-2-4-6-5-3-1/h2-5H,9H2,1H3,(H,10,11);6H,1-5H2
InChI Key:
UXLUVWOCLPTSLC-UHFFFAOYSA-N
SMILES:
C1CCCNC1.Nc1ccc(cc1)S(=O)(=O)NC(=O)C
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.13g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
299.389g/mol
Monoisotopic Mass:
299.13g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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