AA61106
13958-93-5 | 3,5-Dichloroisonicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AA61106
ChemicalName
3,5-Dichloroisonicotinic acid
CasNumber
13958-93-5
MolecularFormula
C6H3Cl2NO2
MolecularWeight
191.9995
MdlNumber
MFCD01861975
Smiles
OC(=O)c1c(Cl)cncc1Cl
Complexity
155
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AA61106
ChemicalName: 3,5-Dichloroisonicotinic acid
CasNumber: 13958-93-5
MolecularFormula: C6H3Cl2NO2
MolecularWeight: 191.9995
MdlNumber: MFCD01861975
Smiles: OC(=O)c1c(Cl)cncc1Cl
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AA61106
ChemicalName:
3,5-Dichloroisonicotinic acid
CasNumber:
13958-93-5
MolecularFormula:
C6H3Cl2NO2
MolecularWeight:
191.9995
MdlNumber:
MFCD01861975
Smiles:
OC(=O)c1c(Cl)cncc1Cl
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AA61107
ChemicalName: 3,5-Dibromopyridine-4-carboxylic acid
CasNumber: 13958-91-3
MolecularFormula: C6H3Br2NO2
MolecularWeight: 280.9015
MdlNumber: MFCD08689615
Smiles: OC(=O)c1c(Br)cncc1Br
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AA61107
ChemicalName:
3,5-Dibromopyridine-4-carboxylic acid
CasNumber:
13958-91-3
MolecularFormula:
C6H3Br2NO2
MolecularWeight:
280.9015
MdlNumber:
MFCD08689615
Smiles:
OC(=O)c1c(Br)cncc1Br
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
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MolecularFormula: __
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Smiles: [O-][n+]1cc(C)c(c(c1)F)[N+](=O)[O-]
Complexity: __
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Xlogp3: __
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Smiles:
[O-][n+]1cc(C)c(c(c1)F)[N+](=O)[O-]
Complexity:
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Smiles: Nc1c(C)cncc1N
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Smiles:
Nc1c(C)cncc1N
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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