AD85580
885273-52-9 | 3-(3-Fluorophenyl)-isoxazole-5-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AD85580
ChemicalName
3-(3-Fluorophenyl)-isoxazole-5-carbaldehyde
CasNumber
885273-52-9
MolecularFormula
C10H6FNO2
MolecularWeight
191.1585
MdlNumber
MFCD06738504
Smiles
O=Cc1onc(c1)c1cccc(c1)F
Complexity
212
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AD85580
ChemicalName: 3-(3-Fluorophenyl)-isoxazole-5-carbaldehyde
CasNumber: 885273-52-9
MolecularFormula: C10H6FNO2
MolecularWeight: 191.1585
MdlNumber: MFCD06738504
Smiles: O=Cc1onc(c1)c1cccc(c1)F
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AD85580
ChemicalName:
3-(3-Fluorophenyl)-isoxazole-5-carbaldehyde
CasNumber:
885273-52-9
MolecularFormula:
C10H6FNO2
MolecularWeight:
191.1585
MdlNumber:
MFCD06738504
Smiles:
O=Cc1onc(c1)c1cccc(c1)F
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.9
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Smiles: COc1ccc2c(c1)c(C=O)c([nH]2)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
COc1ccc2c(c1)c(C=O)c([nH]2)C(=O)OC
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O1CCC(CC1)c1ccc2c(c1)[nH]cc2
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Smiles:
O1CCC(CC1)c1ccc2c(c1)[nH]cc2
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O1CCC(CC1)c1ccc2c(c1)cc[nH]2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O1CCC(CC1)c1ccc2c(c1)cc[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__