AA31787
1257664-90-6 | 1-(4-Bromo-3-trifluoromethylphenyl)piperidin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AA31787
ChemicalName
1-(4-Bromo-3-trifluoromethylphenyl)piperidin-2-one
CasNumber
1257664-90-6
MolecularFormula
C12H11BrF3NO
MolecularWeight
322.121
MdlNumber
MFCD04037069
Smiles
O=C1CCCCN1c1ccc(c(c1)C(F)(F)F)Br
Complexity
321
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
3.3
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CatalogNumber: AA31787
ChemicalName: 1-(4-Bromo-3-trifluoromethylphenyl)piperidin-2-one
CasNumber: 1257664-90-6
MolecularFormula: C12H11BrF3NO
MolecularWeight: 322.121
MdlNumber: MFCD04037069
Smiles: O=C1CCCCN1c1ccc(c(c1)C(F)(F)F)Br
Complexity: 321
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 3.3
CatalogNumber:
AA31787
ChemicalName:
1-(4-Bromo-3-trifluoromethylphenyl)piperidin-2-one
CasNumber:
1257664-90-6
MolecularFormula:
C12H11BrF3NO
MolecularWeight:
322.121
MdlNumber:
MFCD04037069
Smiles:
O=C1CCCCN1c1ccc(c(c1)C(F)(F)F)Br
Complexity:
321
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
3.3
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Smiles: B1(OC(=O)CN(CC(=O)O1)C)C2=CC(=CC=C2)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
B1(OC(=O)CN(CC(=O)O1)C)C2=CC(=CC=C2)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: B1(OC(=O)CN(CC(=O)O1)C)C2=CC=CC=C2C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
B1(OC(=O)CN(CC(=O)O1)C)C2=CC=CC=C2C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__