AF77620
26454-80-8 | 2-(2-Oxo-2-p-tolylethyl)malononitrile
Manufacturer: A2B Chem
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CatalogNumber
AF77620
ChemicalName
2-(2-Oxo-2-p-tolylethyl)malononitrile
CasNumber
26454-80-8
MolecularFormula
C12H10N2O
MolecularWeight
198.2206
MdlNumber
MFCD00477088
Smiles
N#CC(CC(=O)c1ccc(cc1)C)C#N
Complexity
306
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.6
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CatalogNumber: AF77620
ChemicalName: 2-(2-Oxo-2-p-tolylethyl)malononitrile
CasNumber: 26454-80-8
MolecularFormula: C12H10N2O
MolecularWeight: 198.2206
MdlNumber: MFCD00477088
Smiles: N#CC(CC(=O)c1ccc(cc1)C)C#N
Complexity: 306
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AF77620
ChemicalName:
2-(2-Oxo-2-p-tolylethyl)malononitrile
CasNumber:
26454-80-8
MolecularFormula:
C12H10N2O
MolecularWeight:
198.2206
MdlNumber:
MFCD00477088
Smiles:
N#CC(CC(=O)c1ccc(cc1)C)C#N
Complexity:
306
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.6
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C1CC2CN(C(C1)C2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
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Smiles:
O=C1CC2CN(C(C1)C2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: COC(=O)/C(=C/Br)/Br
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MolecularWeight:
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Smiles:
COC(=O)/C(=C/Br)/Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CCCCCCCCCCCC(=O)NCCOCCO
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCCCCCCCC(=O)NCCOCCO
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__