AI48439
34486-06-1 | 6-Trifluoromethylpyridin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AI48439
ChemicalName
6-Trifluoromethylpyridin-2-one
CasNumber
34486-06-1
MolecularFormula
C6H4F3NO
MolecularWeight
163.0973
MdlNumber
MFCD08061317
Smiles
Oc1cccc(n1)C(F)(F)F
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
1.1
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CatalogNumber: AI48439
ChemicalName: 6-Trifluoromethylpyridin-2-one
CasNumber: 34486-06-1
MolecularFormula: C6H4F3NO
MolecularWeight: 163.0973
MdlNumber: MFCD08061317
Smiles: Oc1cccc(n1)C(F)(F)F
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 1.1
CatalogNumber:
AI48439
ChemicalName:
6-Trifluoromethylpyridin-2-one
CasNumber:
34486-06-1
MolecularFormula:
C6H4F3NO
MolecularWeight:
163.0973
MdlNumber:
MFCD08061317
Smiles:
Oc1cccc(n1)C(F)(F)F
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
1.1
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Smiles: [O-]c1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
[O-]c1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: OCC1CCC(=O)N1C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OCC1CCC(=O)N1C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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Smiles: CCOC(=O)c1cc(cc(n1)C(=O)OCC)B(O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)c1cc(cc(n1)C(=O)OCC)B(O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__