AG20625
53812-68-3 | 1-Methyl-4-(3-nitrophenyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AG20625
ChemicalName
1-Methyl-4-(3-nitrophenyl)benzene
CasNumber
53812-68-3
MolecularFormula
C13H11NO2
MolecularWeight
213.2319
MdlNumber
MFCD02246594
Smiles
Cc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
4.2
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CatalogNumber: AG20625
ChemicalName: 1-Methyl-4-(3-nitrophenyl)benzene
CasNumber: 53812-68-3
MolecularFormula: C13H11NO2
MolecularWeight: 213.2319
MdlNumber: MFCD02246594
Smiles: Cc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.2
CatalogNumber:
AG20625
ChemicalName:
1-Methyl-4-(3-nitrophenyl)benzene
CasNumber:
53812-68-3
MolecularFormula:
C13H11NO2
MolecularWeight:
213.2319
MdlNumber:
MFCD02246594
Smiles:
Cc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@](c1ccc(cc1)C)(O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@](c1ccc(cc1)C)(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(CC)(N)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)C(CC)(N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCc2c(C1)c1ccccc1[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCc2c(C1)c1ccccc1[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__