AI51364
505080-54-6 | 3-Fluoro-4-(piperidin-1-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI51364
ChemicalName
3-Fluoro-4-(piperidin-1-yl)benzonitrile
CasNumber
505080-54-6
MolecularFormula
C12H13FN2
MolecularWeight
204.2434
MdlNumber
MFCD03043989
Smiles
N#Cc1ccc(c(c1)F)N1CCCCC1
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.7
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CatalogNumber: AI51364
ChemicalName: 3-Fluoro-4-(piperidin-1-yl)benzonitrile
CasNumber: 505080-54-6
MolecularFormula: C12H13FN2
MolecularWeight: 204.2434
MdlNumber: MFCD03043989
Smiles: N#Cc1ccc(c(c1)F)N1CCCCC1
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.7
CatalogNumber:
AI51364
ChemicalName:
3-Fluoro-4-(piperidin-1-yl)benzonitrile
CasNumber:
505080-54-6
MolecularFormula:
C12H13FN2
MolecularWeight:
204.2434
MdlNumber:
MFCD03043989
Smiles:
N#Cc1ccc(c(c1)F)N1CCCCC1
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.7
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Smiles: OC(=O)c1ccc(cc1F)c1cccs1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1ccc(cc1F)c1cccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc(cc1)c1c(F)cc(cc1F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc(cc1)c1c(F)cc(cc1F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc(cc1F)c1ccccc1C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc(cc1F)c1ccccc1C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__