AG40881
52864-54-7 | 2-(2-Bromo-4-chlorophenyl)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG40881
ChemicalName
2-(2-Bromo-4-chlorophenyl)acetonitrile
CasNumber
52864-54-7
MolecularFormula
C8H5BrClN
MolecularWeight
230.489
MdlNumber
MFCD11044834
Smiles
N#CCc1ccc(cc1Br)Cl
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AG40881
ChemicalName: 2-(2-Bromo-4-chlorophenyl)acetonitrile
CasNumber: 52864-54-7
MolecularFormula: C8H5BrClN
MolecularWeight: 230.489
MdlNumber: MFCD11044834
Smiles: N#CCc1ccc(cc1Br)Cl
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AG40881
ChemicalName:
2-(2-Bromo-4-chlorophenyl)acetonitrile
CasNumber:
52864-54-7
MolecularFormula:
C8H5BrClN
MolecularWeight:
230.489
MdlNumber:
MFCD11044834
Smiles:
N#CCc1ccc(cc1Br)Cl
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
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Smiles: S=C(NC(=O)c1ccc(cc1)Br)Nc1ccc(c(c1)C(=O)O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
S=C(NC(=O)c1ccc(cc1)Br)Nc1ccc(c(c1)C(=O)O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: COc1ccc(cc1C(=O)NC(=S)Nc1cccc(c1)C(=O)O)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1ccc(cc1C(=O)NC(=S)Nc1cccc(c1)C(=O)O)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__