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Home > Sulfanilamide > 1016797-88-8
1016797-88-8 | 1,4-diazepane-1-sulfonamide
CAS No: 1016797-88-8 Catalog No: AG01AH7F MDL No:MFCD09944819
Product Description
Catalog Number:
AG01AH7F
Chemical Name:
1,4-diazepane-1-sulfonamide
CAS Number:
1016797-88-8
Molecular Formula:
C5H13N3O2S
Molecular Weight:
179.2406
MDL Number:
MFCD09944819
IUPAC Name:
1,4-diazepane-1-sulfonamide
InChI:
InChI=1S/C5H13N3O2S/c6-11(9,10)8-4-1-2-7-3-5-8/h7H,1-5H2,(H2,6,9,10)
InChI Key:
OWWXXNVDTAJQFY-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)N1CCNCCC1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.073g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.238g/mol
Monoisotopic Mass:
179.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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