AB61499
53882-80-7 | 2-Bromobenzoylacetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB61499
ChemicalName
2-Bromobenzoylacetonitrile
CasNumber
53882-80-7
MolecularFormula
C9H6BrNO
MolecularWeight
224.054
MdlNumber
MFCD02260798
Smiles
N#CCC(=O)c1ccccc1Br
Complexity
218
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AB61499
ChemicalName: 2-Bromobenzoylacetonitrile
CasNumber: 53882-80-7
MolecularFormula: C9H6BrNO
MolecularWeight: 224.054
MdlNumber: MFCD02260798
Smiles: N#CCC(=O)c1ccccc1Br
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AB61499
ChemicalName:
2-Bromobenzoylacetonitrile
CasNumber:
53882-80-7
MolecularFormula:
C9H6BrNO
MolecularWeight:
224.054
MdlNumber:
MFCD02260798
Smiles:
N#CCC(=O)c1ccccc1Br
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Brc1ccccc1CS(=O)(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Brc1ccccc1CS(=O)(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccccc1Br
Complexity: 85
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
NCc1ccccc1Br
Complexity:
85
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccccc1Br.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccccc1Br.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__