AG66328
60484-68-6 | 4-N-Octylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG66328
ChemicalName
4-N-Octylbenzonitrile
CasNumber
60484-68-6
MolecularFormula
C15H21N
MolecularWeight
215.3339
MdlNumber
MFCD00799351
Smiles
CCCCCCCCc1ccc(cc1)C#N
Complexity
205
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
1
RotatableBondCount
7
Xlogp3
5.4
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CatalogNumber: AG66328
ChemicalName: 4-N-Octylbenzonitrile
CasNumber: 60484-68-6
MolecularFormula: C15H21N
MolecularWeight: 215.3339
MdlNumber: MFCD00799351
Smiles: CCCCCCCCc1ccc(cc1)C#N
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
RotatableBondCount: 7
Xlogp3: 5.4
CatalogNumber:
AG66328
ChemicalName:
4-N-Octylbenzonitrile
CasNumber:
60484-68-6
MolecularFormula:
C15H21N
MolecularWeight:
215.3339
MdlNumber:
MFCD00799351
Smiles:
CCCCCCCCc1ccc(cc1)C#N
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
RotatableBondCount:
7
Xlogp3:
5.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COc1cc(C(=O)O)c(cc1OC)I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1cc(C(=O)O)c(cc1OC)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCOC(=O)C1CN2CCC1CC2
Complexity: __
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HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCOC(=O)C1CN2CCC1CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: OC(=O)[C@@H]1Cc2nc[nH]c2CN1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1Cc2nc[nH]c2CN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__