AB44216
72752-52-4 | 2-Piperidinobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB44216
ChemicalName
2-Piperidinobenzonitrile
CasNumber
72752-52-4
MolecularFormula
C12H14N2
MolecularWeight
186.253
MdlNumber
MFCD00049221
Smiles
N#Cc1ccccc1N1CCCCC1
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AB44216
ChemicalName: 2-Piperidinobenzonitrile
CasNumber: 72752-52-4
MolecularFormula: C12H14N2
MolecularWeight: 186.253
MdlNumber: MFCD00049221
Smiles: N#Cc1ccccc1N1CCCCC1
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AB44216
ChemicalName:
2-Piperidinobenzonitrile
CasNumber:
72752-52-4
MolecularFormula:
C12H14N2
MolecularWeight:
186.253
MdlNumber:
MFCD00049221
Smiles:
N#Cc1ccccc1N1CCCCC1
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCCCN1
Complexity: 80.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCCCN1
Complexity:
80.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.5
CatalogNumber: AB44218
ChemicalName: 1-(Pyridin-2-yl)propan-1-one
CasNumber: 3238-55-9
MolecularFormula: C8H9NO
MolecularWeight: 135.1632
MdlNumber: MFCD00023486
Smiles: CCC(=O)c1ccccn1
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AB44218
ChemicalName:
1-(Pyridin-2-yl)propan-1-one
CasNumber:
3238-55-9
MolecularFormula:
C8H9NO
MolecularWeight:
135.1632
MdlNumber:
MFCD00023486
Smiles:
CCC(=O)c1ccccn1
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC(C(=O)O)CCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC(C(=O)O)CCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__