AG64805
57774-36-4 | 4-(4-Chlorophenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG64805
ChemicalName
4-(4-Chlorophenyl)benzonitrile
CasNumber
57774-36-4
MolecularFormula
C13H8ClN
MolecularWeight
213.6623
MdlNumber
MFCD05980153
Smiles
N#Cc1ccc(cc1)c1ccc(cc1)Cl
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
4.7
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CatalogNumber: AG64805
ChemicalName: 4-(4-Chlorophenyl)benzonitrile
CasNumber: 57774-36-4
MolecularFormula: C13H8ClN
MolecularWeight: 213.6623
MdlNumber: MFCD05980153
Smiles: N#Cc1ccc(cc1)c1ccc(cc1)Cl
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 4.7
CatalogNumber:
AG64805
ChemicalName:
4-(4-Chlorophenyl)benzonitrile
CasNumber:
57774-36-4
MolecularFormula:
C13H8ClN
MolecularWeight:
213.6623
MdlNumber:
MFCD05980153
Smiles:
N#Cc1ccc(cc1)c1ccc(cc1)Cl
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
4.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(C(=O)O)CC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(C(=O)O)CC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(=O)[C@@H](N)C.Cl
Complexity: 72.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(=O)[C@@H](N)C.Cl
Complexity:
72.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)/C(=C/c1ccccc1)/NC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)/C(=C/c1ccccc1)/NC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__