AA31308
1256633-31-4 | 2-Methyl-2-(5-nitropyridin-2-yl)propanenitrile
Manufacturer: A2B Chem
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CatalogNumber
AA31308
ChemicalName
2-Methyl-2-(5-nitropyridin-2-yl)propanenitrile
CasNumber
1256633-31-4
MolecularFormula
C9H9N3O2
MolecularWeight
191.1867
MdlNumber
MFCD18070992
Smiles
N#CC(c1ccc(cn1)[N+](=O)[O-])(C)C
Complexity
274
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AA31308
ChemicalName: 2-Methyl-2-(5-nitropyridin-2-yl)propanenitrile
CasNumber: 1256633-31-4
MolecularFormula: C9H9N3O2
MolecularWeight: 191.1867
MdlNumber: MFCD18070992
Smiles: N#CC(c1ccc(cn1)[N+](=O)[O-])(C)C
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AA31308
ChemicalName:
2-Methyl-2-(5-nitropyridin-2-yl)propanenitrile
CasNumber:
1256633-31-4
MolecularFormula:
C9H9N3O2
MolecularWeight:
191.1867
MdlNumber:
MFCD18070992
Smiles:
N#CC(c1ccc(cn1)[N+](=O)[O-])(C)C
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1cc(F)ccc1N1CCN(CC1)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)c1cc(F)ccc1N1CCN(CC1)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCOC(=O)c1ncn2c1c(Cl)ncc2Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
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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:
CCOC(=O)c1ncn2c1c(Cl)ncc2Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(O)ccn1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(O)ccn1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__