AA38754
13014-48-7 | (4-Chloro-phenyl)-oxo-acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA38754
ChemicalName
(4-Chloro-phenyl)-oxo-acetonitrile
CasNumber
13014-48-7
MolecularFormula
C8H4ClNO
MolecularWeight
165.5765
MdlNumber
MFCD06658396
Smiles
N#CC(=O)c1ccc(cc1)Cl
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AA38754
ChemicalName: (4-Chloro-phenyl)-oxo-acetonitrile
CasNumber: 13014-48-7
MolecularFormula: C8H4ClNO
MolecularWeight: 165.5765
MdlNumber: MFCD06658396
Smiles: N#CC(=O)c1ccc(cc1)Cl
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AA38754
ChemicalName:
(4-Chloro-phenyl)-oxo-acetonitrile
CasNumber:
13014-48-7
MolecularFormula:
C8H4ClNO
MolecularWeight:
165.5765
MdlNumber:
MFCD06658396
Smiles:
N#CC(=O)c1ccc(cc1)Cl
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.7
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Smiles: CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Zn+2]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Zn+2]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Clc1ccc(cc1Cl)C(Cl)(Cl)Cl
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MolecularFormula:
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MolecularWeight:
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Smiles:
Clc1ccc(cc1Cl)C(Cl)(Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(c(c1)Cl)C(Cl)(Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1ccc(c(c1)Cl)C(Cl)(Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__