AI38743
169674-35-5 | 5,6-Difluoroindole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI38743
ChemicalName
5,6-Difluoroindole-2-carboxylic acid
CasNumber
169674-35-5
MolecularFormula
C9H5F2NO2
MolecularWeight
197.1383
MdlNumber
MFCD01863160
Smiles
Fc1cc2[nH]c(cc2cc1F)C(=O)O
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AI38743
ChemicalName: 5,6-Difluoroindole-2-carboxylic acid
CasNumber: 169674-35-5
MolecularFormula: C9H5F2NO2
MolecularWeight: 197.1383
MdlNumber: MFCD01863160
Smiles: Fc1cc2[nH]c(cc2cc1F)C(=O)O
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AI38743
ChemicalName:
5,6-Difluoroindole-2-carboxylic acid
CasNumber:
169674-35-5
MolecularFormula:
C9H5F2NO2
MolecularWeight:
197.1383
MdlNumber:
MFCD01863160
Smiles:
Fc1cc2[nH]c(cc2cc1F)C(=O)O
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.1
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Smiles: Cc1ccc2c(n1)[nH]nc2Br
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Cc1ccc2c(n1)[nH]nc2Br
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(C)(C)OC(=O)N1CC2=C(C1)CNC2
Complexity: __
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__
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MolecularFormula:
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Smiles:
CC(C)(C)OC(=O)N1CC2=C(C1)CNC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
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__
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Smiles: N[C@H](C(=O)O)C[C@@H](C(=O)O)Cc1ccccc1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@H](C(=O)O)C[C@@H](C(=O)O)Cc1ccccc1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__