AE36777
142596-50-7 | 3-Methoxy-2-nitrobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE36777
ChemicalName
3-Methoxy-2-nitrobenzonitrile
CasNumber
142596-50-7
MolecularFormula
C8H6N2O3
MolecularWeight
178.1448
MdlNumber
MFCD18382535
Smiles
COc1cccc(c1[N+](=O)[O-])C#N
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
1.4
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CatalogNumber: AE36777
ChemicalName: 3-Methoxy-2-nitrobenzonitrile
CasNumber: 142596-50-7
MolecularFormula: C8H6N2O3
MolecularWeight: 178.1448
MdlNumber: MFCD18382535
Smiles: COc1cccc(c1[N+](=O)[O-])C#N
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AE36777
ChemicalName:
3-Methoxy-2-nitrobenzonitrile
CasNumber:
142596-50-7
MolecularFormula:
C8H6N2O3
MolecularWeight:
178.1448
MdlNumber:
MFCD18382535
Smiles:
COc1cccc(c1[N+](=O)[O-])C#N
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: [O-][N+](=O)c1cccc2c1c(C)c[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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Smiles:
[O-][N+](=O)c1cccc2c1c(C)c[nH]2
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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__
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Smiles: Fc1c[nH]c2c1c(Cl)ccn2
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Smiles:
Fc1c[nH]c2c1c(Cl)ccn2
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: N1CC2(C1)CCN(CC2)Cc1ccccc1
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HydrogenBondAcceptorCount: __
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CasNumber:
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MolecularFormula:
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Smiles:
N1CC2(C1)CCN(CC2)Cc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__