AD11593
952-21-6 | 1-Methyl-3-(4-nitrophenyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AD11593
ChemicalName
1-Methyl-3-(4-nitrophenyl)benzene
CasNumber
952-21-6
MolecularFormula
C13H11NO2
MolecularWeight
213.2319
MdlNumber
MFCD00452721
Smiles
Cc1cccc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
4.2
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CatalogNumber: AD11593
ChemicalName: 1-Methyl-3-(4-nitrophenyl)benzene
CasNumber: 952-21-6
MolecularFormula: C13H11NO2
MolecularWeight: 213.2319
MdlNumber: MFCD00452721
Smiles: Cc1cccc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.2
CatalogNumber:
AD11593
ChemicalName:
1-Methyl-3-(4-nitrophenyl)benzene
CasNumber:
952-21-6
MolecularFormula:
C13H11NO2
MolecularWeight:
213.2319
MdlNumber:
MFCD00452721
Smiles:
Cc1cccc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.2
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MolecularFormula: __
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Smiles: CCOC(=O)CNCc1ccc(cc1OC)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
CCOC(=O)CNCc1ccc(cc1OC)OC
Complexity:
__
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=Cc1ccc(cc1)c1nccc(c1)C(F)(F)F
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Smiles:
O=Cc1ccc(cc1)c1nccc(c1)C(F)(F)F
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: COC(=O)c1cc2c([nH]1)ncc(c2)Cl
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HydrogenBondAcceptorCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)c1cc2c([nH]1)ncc(c2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__