AB25952
247564-66-5 | 4,6-Difluoroindole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB25952
ChemicalName
4,6-Difluoroindole-2-carboxylic acid
CasNumber
247564-66-5
MolecularFormula
C9H5F2NO2
MolecularWeight
197.13830639999998
MdlNumber
MFCD01863158
Smiles
Fc1cc(F)c2c(c1)[nH]c(c2)C(=O)O
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AB25952
ChemicalName: 4,6-Difluoroindole-2-carboxylic acid
CasNumber: 247564-66-5
MolecularFormula: C9H5F2NO2
MolecularWeight: 197.13830639999998
MdlNumber: MFCD01863158
Smiles: Fc1cc(F)c2c(c1)[nH]c(c2)C(=O)O
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB25952
ChemicalName:
4,6-Difluoroindole-2-carboxylic acid
CasNumber:
247564-66-5
MolecularFormula:
C9H5F2NO2
MolecularWeight:
197.13830639999998
MdlNumber:
MFCD01863158
Smiles:
Fc1cc(F)c2c(c1)[nH]c(c2)C(=O)O
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Fc1ccc2c(c1F)cc[nH]2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Fc1ccc2c(c1F)cc[nH]2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: ClCc1c(F)cc(cc1F)F
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Smiles:
ClCc1c(F)cc(cc1F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1nc(OC)nc2N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]1O[C@H](C[C@@H]1O)n1cnc2c1nc(OC)nc2N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__