AB50040
171178-50-0 | 2,6-Difluoronicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AB50040
ChemicalName
2,6-Difluoronicotinic acid
CasNumber
171178-50-0
MolecularFormula
C6H3F2NO2
MolecularWeight
159.0903
MdlNumber
MFCD08064047
Smiles
OC(=O)c1ccc(nc1F)F
Complexity
165
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AB50040
ChemicalName: 2,6-Difluoronicotinic acid
CasNumber: 171178-50-0
MolecularFormula: C6H3F2NO2
MolecularWeight: 159.0903
MdlNumber: MFCD08064047
Smiles: OC(=O)c1ccc(nc1F)F
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AB50040
ChemicalName:
2,6-Difluoronicotinic acid
CasNumber:
171178-50-0
MolecularFormula:
C6H3F2NO2
MolecularWeight:
159.0903
MdlNumber:
MFCD08064047
Smiles:
OC(=O)c1ccc(nc1F)F
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: SCCCCCn1c2ccccc2c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
SCCCCCn1c2ccccc2c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#CC(O)(C)C
Complexity: 83.4
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#CC(O)(C)C
Complexity:
83.4
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3
CatalogNumber: AB50043
ChemicalName: 5-Bromo-3-methoxypyridin-2(1h)-one
CasNumber: 1189757-62-7
MolecularFormula: C6H6BrNO2
MolecularWeight: 204.0213
MdlNumber: MFCD17676138
Smiles: COc1cc(Br)c[nH]c1=O
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AB50043
ChemicalName:
5-Bromo-3-methoxypyridin-2(1h)-one
CasNumber:
1189757-62-7
MolecularFormula:
C6H6BrNO2
MolecularWeight:
204.0213
MdlNumber:
MFCD17676138
Smiles:
COc1cc(Br)c[nH]c1=O
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.8