AB67943
5333-27-7 | 4'-Methyl-3'-nitroacetophenone
Manufacturer: A2B Chem
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CatalogNumber
AB67943
ChemicalName
4'-Methyl-3'-nitroacetophenone
CasNumber
5333-27-7
MolecularFormula
C9H9NO3
MolecularWeight
179.1727
MdlNumber
MFCD00033858
Smiles
[O-][N+](=O)c1cc(ccc1C)C(=O)C
NscNumber
617
Complexity
221
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AB67943
ChemicalName: 4'-Methyl-3'-nitroacetophenone
CasNumber: 5333-27-7
MolecularFormula: C9H9NO3
MolecularWeight: 179.1727
MdlNumber: MFCD00033858
Smiles: [O-][N+](=O)c1cc(ccc1C)C(=O)C
NscNumber: 617
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB67943
ChemicalName:
4'-Methyl-3'-nitroacetophenone
CasNumber:
5333-27-7
MolecularFormula:
C9H9NO3
MolecularWeight:
179.1727
MdlNumber:
MFCD00033858
Smiles:
[O-][N+](=O)c1cc(ccc1C)C(=O)C
NscNumber:
617
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: AB67944
ChemicalName: 4-Methyl-3-nitrobenzenesulfonyl chloride
CasNumber: 616-83-1
MolecularFormula: C7H6ClNO4S
MolecularWeight: 235.6448
MdlNumber: MFCD00129811
Smiles: [O-][N+](=O)c1cc(ccc1C)S(=O)(=O)Cl
NscNumber: __
Complexity: 318
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB67944
ChemicalName:
4-Methyl-3-nitrobenzenesulfonyl chloride
CasNumber:
616-83-1
MolecularFormula:
C7H6ClNO4S
MolecularWeight:
235.6448
MdlNumber:
MFCD00129811
Smiles:
[O-][N+](=O)c1cc(ccc1C)S(=O)(=O)Cl
NscNumber:
__
Complexity:
318
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: AB67945
ChemicalName: 4-Methyl-3-nitrobenzenesulfonamide
CasNumber: 6949-23-1
MolecularFormula: C7H8N2O4S
MolecularWeight: 216.21442000000002
MdlNumber: MFCD00460611
Smiles: O=N(=O)c1cc(ccc1C)S(=O)(=O)N
NscNumber: __
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB67945
ChemicalName:
4-Methyl-3-nitrobenzenesulfonamide
CasNumber:
6949-23-1
MolecularFormula:
C7H8N2O4S
MolecularWeight:
216.21442000000002
MdlNumber:
MFCD00460611
Smiles:
O=N(=O)c1cc(ccc1C)S(=O)(=O)N
NscNumber:
__
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1C)C(=O)O
NscNumber: __
Complexity: 223
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1C)C(=O)O
NscNumber:
__
Complexity:
223
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9