AD87316
887973-53-7 | 5-(3,5-Dichlorophenyl)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AD87316
ChemicalName
5-(3,5-Dichlorophenyl)nicotinic acid
CasNumber
887973-53-7
MolecularFormula
C12H7Cl2NO2
MolecularWeight
268.0955
MdlNumber
MFCD06410288
Smiles
Clc1cc(Cl)cc(c1)c1cncc(c1)C(=O)O
Complexity
278
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AD87316
ChemicalName: 5-(3,5-Dichlorophenyl)nicotinic acid
CasNumber: 887973-53-7
MolecularFormula: C12H7Cl2NO2
MolecularWeight: 268.0955
MdlNumber: MFCD06410288
Smiles: Clc1cc(Cl)cc(c1)c1cncc(c1)C(=O)O
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AD87316
ChemicalName:
5-(3,5-Dichlorophenyl)nicotinic acid
CasNumber:
887973-53-7
MolecularFormula:
C12H7Cl2NO2
MolecularWeight:
268.0955
MdlNumber:
MFCD06410288
Smiles:
Clc1cc(Cl)cc(c1)c1cncc(c1)C(=O)O
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1nccc(c1)c1cccc(c1)NS(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1nccc(c1)c1cccc(c1)NS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD87325
ChemicalName: 6-Acetamido-3-bromopicolinic acid
CasNumber: 882430-69-5
MolecularFormula: C8H7BrN2O3
MolecularWeight: 259.0568
MdlNumber: MFCD08235101
Smiles: CC(=O)Nc1ccc(c(n1)C(=O)O)Br
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AD87325
ChemicalName:
6-Acetamido-3-bromopicolinic acid
CasNumber:
882430-69-5
MolecularFormula:
C8H7BrN2O3
MolecularWeight:
259.0568
MdlNumber:
MFCD08235101
Smiles:
CC(=O)Nc1ccc(c(n1)C(=O)O)Br
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.9
CatalogNumber: AD87337
ChemicalName: 2-Oxetanemethanamine
CasNumber: 882402-12-2
MolecularFormula: C4H9NO
MolecularWeight: 87.12035999999999
MdlNumber: MFCD17214171
Smiles: NCC1CCO1
Complexity: 46.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.7
CatalogNumber:
AD87337
ChemicalName:
2-Oxetanemethanamine
CasNumber:
882402-12-2
MolecularFormula:
C4H9NO
MolecularWeight:
87.12035999999999
MdlNumber:
MFCD17214171
Smiles:
NCC1CCO1
Complexity:
46.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.7