AA70231
1437794-28-9 | 1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA70231
ChemicalName
1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
CasNumber
1437794-28-9
MolecularFormula
C10H11F3N2O2
MolecularWeight
248.2017
MdlNumber
MFCD24448787
Smiles
O=Cc1cc(nn1C1CCCCO1)C(F)(F)F
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.7
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CatalogNumber: AA70231
ChemicalName: 1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
CasNumber: 1437794-28-9
MolecularFormula: C10H11F3N2O2
MolecularWeight: 248.2017
MdlNumber: MFCD24448787
Smiles: O=Cc1cc(nn1C1CCCCO1)C(F)(F)F
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.7
CatalogNumber:
AA70231
ChemicalName:
1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
CasNumber:
1437794-28-9
MolecularFormula:
C10H11F3N2O2
MolecularWeight:
248.2017
MdlNumber:
MFCD24448787
Smiles:
O=Cc1cc(nn1C1CCCCO1)C(F)(F)F
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.7
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Smiles: Fc1cnc2c(c1)nccc2O
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Fc1cnc2c(c1)nccc2O
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Smiles: NC(=N)NCc1cccc(c1)[Si](C)(C)C
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NC(=N)NCc1cccc(c1)[Si](C)(C)C
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Smiles: CCCCCCCCC(=O)c1ccccn1
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Smiles:
CCCCCCCCC(=O)c1ccccn1
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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