AA30096
125224-43-3 | ((3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AA30096
ChemicalName
((3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl)methanol
CasNumber
125224-43-3
MolecularFormula
C12H16FNO
MolecularWeight
209.2599
MdlNumber
MFCD03839921
Smiles
OC[C@@H]1CNCC[C@H]1c1ccc(cc1)F
Complexity
192
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AA30096
ChemicalName: ((3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl)methanol
CasNumber: 125224-43-3
MolecularFormula: C12H16FNO
MolecularWeight: 209.2599
MdlNumber: MFCD03839921
Smiles: OC[C@@H]1CNCC[C@H]1c1ccc(cc1)F
Complexity: 192
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AA30096
ChemicalName:
((3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl)methanol
CasNumber:
125224-43-3
MolecularFormula:
C12H16FNO
MolecularWeight:
209.2599
MdlNumber:
MFCD03839921
Smiles:
OC[C@@H]1CNCC[C@H]1c1ccc(cc1)F
Complexity:
192
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)n1cc(c(n1)C)Br
Complexity: 207
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1ccc(cc1)n1cc(c(n1)C)Br
Complexity:
207
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)c1cc2c([nH]1)cncc2Br
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
OC(=O)c1cc2c([nH]1)cncc2Br
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)NCC1CCN(CC1)C(=O)C1COc2c(O1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)NCC1CCN(CC1)C(=O)C1COc2c(O1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__