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Home > Nitro Compounds > 924869-20-5
924869-20-5 | 1-[(4-NITROPHENYL)SULFONYL]TETRAHYDRO-4(1H)-PYRIDINONE
CAS No: 924869-20-5 Catalog No: AG00H1Z6 MDL No:MFCD08689704
Product Description
Catalog Number:
AG00H1Z6
Chemical Name:
1-[(4-NITROPHENYL)SULFONYL]TETRAHYDRO-4(1H)-PYRIDINONE
CAS Number:
924869-20-5
Molecular Formula:
C11H12N2O5S
Molecular Weight:
284.2884
MDL Number:
MFCD08689704
IUPAC Name:
1-(4-nitrophenyl)sulfonylpiperidin-4-one
InChI:
InChI=1S/C11H12N2O5S/c14-10-5-7-12(8-6-10)19(17,18)11-3-1-9(2-4-11)13(15)16/h1-4H,5-8H2
InChI Key:
BXFUYAKJRYAMHR-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.047g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.286g/mol
Monoisotopic Mass:
284.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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