AF32995
28314-81-0 | 3-Bromo-2,6-difluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF32995
ChemicalName
3-Bromo-2,6-difluorobenzoic acid
CasNumber
28314-81-0
MolecularFormula
C7H3BrF2O2
MolecularWeight
236.9983
MdlNumber
MFCD09261248
Smiles
OC(=O)c1c(F)ccc(c1F)Br
Complexity
188
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AF32995
ChemicalName: 3-Bromo-2,6-difluorobenzoic acid
CasNumber: 28314-81-0
MolecularFormula: C7H3BrF2O2
MolecularWeight: 236.9983
MdlNumber: MFCD09261248
Smiles: OC(=O)c1c(F)ccc(c1F)Br
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AF32995
ChemicalName:
3-Bromo-2,6-difluorobenzoic acid
CasNumber:
28314-81-0
MolecularFormula:
C7H3BrF2O2
MolecularWeight:
236.9983
MdlNumber:
MFCD09261248
Smiles:
OC(=O)c1c(F)ccc(c1F)Br
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AF32996
ChemicalName: 5-Hydroxypyridine-2-carbaldehyde
CasNumber: 31191-08-9
MolecularFormula: C6H5NO2
MolecularWeight: 123.1094
MdlNumber: MFCD10697538
Smiles: O=Cc1ccc(cn1)O
Complexity: 105
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.3
CatalogNumber:
AF32996
ChemicalName:
5-Hydroxypyridine-2-carbaldehyde
CasNumber:
31191-08-9
MolecularFormula:
C6H5NO2
MolecularWeight:
123.1094
MdlNumber:
MFCD10697538
Smiles:
O=Cc1ccc(cn1)O
Complexity:
105
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.3
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Smiles: C(=NN)(N)N.C(=O)(O)O
Complexity: __
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Smiles:
C(=NN)(N)N.C(=O)(O)O
Complexity:
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RotatableBondCount:
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Smiles: C1CNC1C(=O)O
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Smiles:
C1CNC1C(=O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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