AA91422
173186-91-9 | 1-Benzyl-3,3-dimethylpiperidin-4-one
Manufacturer: A2B Chem
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CatalogNumber
AA91422
ChemicalName
1-Benzyl-3,3-dimethylpiperidin-4-one
CasNumber
173186-91-9
MolecularFormula
C14H19NO
MolecularWeight
217.3068
MdlNumber
MFCD09908040
Smiles
O=C1CCN(CC1(C)C)Cc1ccccc1
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AA91422
ChemicalName: 1-Benzyl-3,3-dimethylpiperidin-4-one
CasNumber: 173186-91-9
MolecularFormula: C14H19NO
MolecularWeight: 217.3068
MdlNumber: MFCD09908040
Smiles: O=C1CCN(CC1(C)C)Cc1ccccc1
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AA91422
ChemicalName:
1-Benzyl-3,3-dimethylpiperidin-4-one
CasNumber:
173186-91-9
MolecularFormula:
C14H19NO
MolecularWeight:
217.3068
MdlNumber:
MFCD09908040
Smiles:
O=C1CCN(CC1(C)C)Cc1ccccc1
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.1
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Smiles: CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H]([C@@H]2O)O)C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H]([C@@H]2O)O)C)C
Complexity:
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RotatableBondCount:
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Smiles: OCCN(CCNc1ccc(c2c1c(=O)c1c(s2)cc(cc1)Cl)CO)CC
Complexity: __
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Smiles:
OCCN(CCNc1ccc(c2c1c(=O)c1c(s2)cc(cc1)Cl)CO)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCPCCCC
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Smiles:
CCCCPCCCC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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