AA09981
1025992-48-6 | 4-(3,5-Dichlorophenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA09981
ChemicalName
4-(3,5-Dichlorophenyl)benzonitrile
CasNumber
1025992-48-6
MolecularFormula
C13H7Cl2N
MolecularWeight
248.1074
MdlNumber
MFCD20529470
Smiles
N#Cc1ccc(cc1)c1cc(Cl)cc(c1)Cl
Complexity
265
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
4.5
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CatalogNumber: AA09981
ChemicalName: 4-(3,5-Dichlorophenyl)benzonitrile
CasNumber: 1025992-48-6
MolecularFormula: C13H7Cl2N
MolecularWeight: 248.1074
MdlNumber: MFCD20529470
Smiles: N#Cc1ccc(cc1)c1cc(Cl)cc(c1)Cl
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 4.5
CatalogNumber:
AA09981
ChemicalName:
4-(3,5-Dichlorophenyl)benzonitrile
CasNumber:
1025992-48-6
MolecularFormula:
C13H7Cl2N
MolecularWeight:
248.1074
MdlNumber:
MFCD20529470
Smiles:
N#Cc1ccc(cc1)c1cc(Cl)cc(c1)Cl
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
4.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H](NC(=O)c1c(Cl)cc2c(c1Cl)CCN(C2)C(=O)c1ccc2c(c1)occ2)Cc1cccc(c1)S(=O)(=O)C
Complexity: 1100
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.7
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)[C@@H](NC(=O)c1c(Cl)cc2c(c1Cl)CCN(C2)C(=O)c1ccc2c(c1)occ2)Cc1cccc(c1)S(=O)(=O)C
Complexity:
1100
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc(cc1)c1nc2n(c1CC(=O)O)cc(cc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)c1ccc(cc1)c1nc2n(c1CC(=O)O)cc(cc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: OCc1scnc1Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OCc1scnc1Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__