AC04684
885588-12-5 | 2-Bromo-5-fluoroisonicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AC04684
ChemicalName
2-Bromo-5-fluoroisonicotinic acid
CasNumber
885588-12-5
MolecularFormula
C6H3BrFNO2
MolecularWeight
219.9959
MdlNumber
MFCD18426717
Smiles
Brc1ncc(c(c1)C(=O)O)F
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AC04684
ChemicalName: 2-Bromo-5-fluoroisonicotinic acid
CasNumber: 885588-12-5
MolecularFormula: C6H3BrFNO2
MolecularWeight: 219.9959
MdlNumber: MFCD18426717
Smiles: Brc1ncc(c(c1)C(=O)O)F
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AC04684
ChemicalName:
2-Bromo-5-fluoroisonicotinic acid
CasNumber:
885588-12-5
MolecularFormula:
C6H3BrFNO2
MolecularWeight:
219.9959
MdlNumber:
MFCD18426717
Smiles:
Brc1ncc(c(c1)C(=O)O)F
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
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MolecularFormula: __
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Smiles: CCCCC[C@@H](C/C=C/1[C@@H](CC=CCCCC(=O)O)C=CC1=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCCC[C@@H](C/C=C/1[C@@H](CC=CCCCC(=O)O)C=CC1=O)O
Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: Clc1cccc(c1C(=O)n1ccnc1C)Cl
Complexity: __
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RotatableBondCount: __
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Smiles:
Clc1cccc(c1C(=O)n1ccnc1C)Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Cc1n(C)c2c(c1C)c1ccccc1cc2
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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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:
Cc1n(C)c2c(c1C)c1ccccc1cc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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