AB67698
51498-37-4 | 4-Hydroxypyridine-3-sulfonic acid
Manufacturer: A2B Chem
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CatalogNumber
AB67698
ChemicalName
4-Hydroxypyridine-3-sulfonic acid
CasNumber
51498-37-4
MolecularFormula
C5H5NO4S
MolecularWeight
175.1625
MdlNumber
MFCD02093473
Smiles
Oc1ccncc1S(=O)(=O)O
Complexity
332
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.4
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CatalogNumber: AB67698
ChemicalName: 4-Hydroxypyridine-3-sulfonic acid
CasNumber: 51498-37-4
MolecularFormula: C5H5NO4S
MolecularWeight: 175.1625
MdlNumber: MFCD02093473
Smiles: Oc1ccncc1S(=O)(=O)O
Complexity: 332
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.4
CatalogNumber:
AB67698
ChemicalName:
4-Hydroxypyridine-3-sulfonic acid
CasNumber:
51498-37-4
MolecularFormula:
C5H5NO4S
MolecularWeight:
175.1625
MdlNumber:
MFCD02093473
Smiles:
Oc1ccncc1S(=O)(=O)O
Complexity:
332
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccncn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccncn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(O)c2c(n1)cccc2.O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(O)c2c(n1)cccc2.O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67701
ChemicalName: 4-Hydroxyquinoline-3-carboxylic acid ethyl ester
CasNumber: 26892-90-0
MolecularFormula: C12H11NO3
MolecularWeight: 217.2206
MdlNumber: MFCD00173406
Smiles: CCOC(=O)c1c[nH]c2c(c1=O)cccc2
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AB67701
ChemicalName:
4-Hydroxyquinoline-3-carboxylic acid ethyl ester
CasNumber:
26892-90-0
MolecularFormula:
C12H11NO3
MolecularWeight:
217.2206
MdlNumber:
MFCD00173406
Smiles:
CCOC(=O)c1c[nH]c2c(c1=O)cccc2
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2