AC92865
939-79-7 | 4-Methyl-3-nitrobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AC92865
ChemicalName
4-Methyl-3-nitrobenzonitrile
CasNumber
939-79-7
MolecularFormula
C8H6N2O2
MolecularWeight
162.14543999999998
MdlNumber
MFCD00031482
Smiles
N#Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
Xlogp3
2.1
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CatalogNumber: AC92865
ChemicalName: 4-Methyl-3-nitrobenzonitrile
CasNumber: 939-79-7
MolecularFormula: C8H6N2O2
MolecularWeight: 162.14543999999998
MdlNumber: MFCD00031482
Smiles: N#Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
Xlogp3: 2.1
CatalogNumber:
AC92865
ChemicalName:
4-Methyl-3-nitrobenzonitrile
CasNumber:
939-79-7
MolecularFormula:
C8H6N2O2
MolecularWeight:
162.14543999999998
MdlNumber:
MFCD00031482
Smiles:
N#Cc1ccc(c(c1)[N+](=O)[O-])C
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
Xlogp3:
2.1
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: [O-][N+](=O)c1ccc(cc1)OCC1ON=C(C1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
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Smiles:
[O-][N+](=O)c1ccc(cc1)OCC1ON=C(C1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Xlogp3:
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Smiles: OCC1OC(Oc2ccc(cc2)[N+](=O)[O-])C(C(C1O)OC1OC(CO)C(C(C1O)O)O)O
Complexity: __
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MolecularFormula:
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Smiles:
OCC1OC(Oc2ccc(cc2)[N+](=O)[O-])C(C(C1O)OC1OC(CO)C(C(C1O)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
__
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Smiles: ClC1(Cl)CC1Cc1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
ClC1(Cl)CC1Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__