AF86093
370-06-9 | 1,1,1-trifluoro-3-(pyridin-2-yl)propan-2-one
Manufacturer: A2B Chem
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CatalogNumber
AF86093
ChemicalName
1,1,1-trifluoro-3-(pyridin-2-yl)propan-2-one
CasNumber
370-06-9
MolecularFormula
C8H6F3NO
MolecularWeight
189.1345
MdlNumber
MFCD00487346
Smiles
O=C(C(F)(F)F)Cc1ccccn1
NscNumber
80336
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AF86093
ChemicalName: 1,1,1-trifluoro-3-(pyridin-2-yl)propan-2-one
CasNumber: 370-06-9
MolecularFormula: C8H6F3NO
MolecularWeight: 189.1345
MdlNumber: MFCD00487346
Smiles: O=C(C(F)(F)F)Cc1ccccn1
NscNumber: 80336
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AF86093
ChemicalName:
1,1,1-trifluoro-3-(pyridin-2-yl)propan-2-one
CasNumber:
370-06-9
MolecularFormula:
C8H6F3NO
MolecularWeight:
189.1345
MdlNumber:
MFCD00487346
Smiles:
O=C(C(F)(F)F)Cc1ccccn1
NscNumber:
80336
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
1.6
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Smiles: O=C(C(F)(F)F)C=C(C)C
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Complexity: __
Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(C(F)(F)F)C=C(C)C
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HydrogenBondAcceptorCount:
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Smiles: c1ccc(cc1)C12CC3CC(C2)(CC(C1)(C3)c1ccccc1)c1ccccc1
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Smiles:
c1ccc(cc1)C12CC3CC(C2)(CC(C1)(C3)c1ccccc1)c1ccccc1
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Complexity:
__
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Smiles: CN1C(c2ccccc2)N(c2c1cccc2)C
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CN1C(c2ccccc2)N(c2c1cccc2)C
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__