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878386-22-2 | 3-Oxopiperazine-1-sulfonamide
CAS No: 878386-22-2 Catalog No: AG01FMPQ MDL No:MFCD11205214
Product Description
Catalog Number:
AG01FMPQ
Chemical Name:
3-Oxopiperazine-1-sulfonamide
CAS Number:
878386-22-2
Molecular Formula:
C4H9N3O3S
Molecular Weight:
179.1976
MDL Number:
MFCD11205214
IUPAC Name:
3-oxopiperazine-1-sulfonamide
InChI:
InChI=1S/C4H9N3O3S/c5-11(9,10)7-2-1-6-4(8)3-7/h1-3H2,(H,6,8)(H2,5,9,10)
InChI Key:
ONBCOARFCGLSKQ-UHFFFAOYSA-N
SMILES:
O=C1NCCN(C1)S(=O)(=O)N
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.194g/mol
Monoisotopic Mass:
179.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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