AB79867
68065-81-6 | 4'-(Trans-4-pentylcyclohexyl)-[1,1'-biphenyl]-4-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB79867
ChemicalName
4'-(Trans-4-pentylcyclohexyl)-[1,1'-biphenyl]-4-carbonitrile
CasNumber
68065-81-6
MolecularFormula
C24H29N
MolecularWeight
331.4938
MdlNumber
MFCD01076317
Smiles
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)C#N
Complexity
409
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
1
RotatableBondCount
6
Xlogp3
8.2
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CatalogNumber: AB79867
ChemicalName: 4'-(Trans-4-pentylcyclohexyl)-[1,1'-biphenyl]-4-carbonitrile
CasNumber: 68065-81-6
MolecularFormula: C24H29N
MolecularWeight: 331.4938
MdlNumber: MFCD01076317
Smiles: CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)C#N
Complexity: 409
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 1
RotatableBondCount: 6
Xlogp3: 8.2
CatalogNumber:
AB79867
ChemicalName:
4'-(Trans-4-pentylcyclohexyl)-[1,1'-biphenyl]-4-carbonitrile
CasNumber:
68065-81-6
MolecularFormula:
C24H29N
MolecularWeight:
331.4938
MdlNumber:
MFCD01076317
Smiles:
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)C#N
Complexity:
409
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
1
RotatableBondCount:
6
Xlogp3:
8.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC=CCCC=O
Complexity: 105
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC=CCCC=O
Complexity:
105
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(c1ccc(cc1)/C=C/C#N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(c1ccc(cc1)/C=C/C#N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC[C@@H]1CC[C@H](CC1)C(=O)O
Complexity: 135
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC[C@@H]1CC[C@H](CC1)C(=O)O
Complexity:
135
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7