AG79857
56825-33-3 | 2-(Ethanesulfonyl)-3-nitropyridine
Manufacturer: A2B Chem
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CatalogNumber
AG79857
ChemicalName
2-(Ethanesulfonyl)-3-nitropyridine
CasNumber
56825-33-3
MolecularFormula
C7H8N2O4S
MolecularWeight
216.2144
MdlNumber
MFCD25121758
Smiles
CCS(=O)(=O)c1ncccc1[N+](=O)[O-]
Complexity
303
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AG79857
ChemicalName: 2-(Ethanesulfonyl)-3-nitropyridine
CasNumber: 56825-33-3
MolecularFormula: C7H8N2O4S
MolecularWeight: 216.2144
MdlNumber: MFCD25121758
Smiles: CCS(=O)(=O)c1ncccc1[N+](=O)[O-]
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AG79857
ChemicalName:
2-(Ethanesulfonyl)-3-nitropyridine
CasNumber:
56825-33-3
MolecularFormula:
C7H8N2O4S
MolecularWeight:
216.2144
MdlNumber:
MFCD25121758
Smiles:
CCS(=O)(=O)c1ncccc1[N+](=O)[O-]
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
0.6
CatalogNumber: AG79858
ChemicalName: 1-Chloro-5-nitronaphthalene
CasNumber: 605-63-0
MolecularFormula: C10H6ClNO2
MolecularWeight: 207.6131
MdlNumber: MFCD01026465
Smiles: [O-][N+](=O)c1cccc2c1cccc2Cl
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
AG79858
ChemicalName:
1-Chloro-5-nitronaphthalene
CasNumber:
605-63-0
MolecularFormula:
C10H6ClNO2
MolecularWeight:
207.6131
MdlNumber:
MFCD01026465
Smiles:
[O-][N+](=O)c1cccc2c1cccc2Cl
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: AG79859
ChemicalName: 1-(2-Methylpropoxy)-4-nitrobenzene
CasNumber: 57027-72-2
MolecularFormula: C10H13NO3
MolecularWeight: 195.2151
MdlNumber: MFCD21985346
Smiles: CC(COc1ccc(cc1)[N+](=O)[O-])C
Complexity: 180
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AG79859
ChemicalName:
1-(2-Methylpropoxy)-4-nitrobenzene
CasNumber:
57027-72-2
MolecularFormula:
C10H13NO3
MolecularWeight:
195.2151
MdlNumber:
MFCD21985346
Smiles:
CC(COc1ccc(cc1)[N+](=O)[O-])C
Complexity:
180
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C(Cc1ccc(cc1)F)N.Cl
Complexity: 191
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C(Cc1ccc(cc1)F)N.Cl
Complexity:
191
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__