AB75998
1065074-46-5 | Methyl 6-bromo-7-chloro-8-methyl-4-hydroxyquinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75998
ChemicalName
Methyl 6-bromo-7-chloro-8-methyl-4-hydroxyquinoline-2-carboxylate
CasNumber
1065074-46-5
MolecularFormula
C12H9BrClNO3
MolecularWeight
330.5618
MdlNumber
MFCD11053780
Smiles
COC(=O)c1cc(O)c2c(n1)c(C)c(c(c2)Br)Cl
Complexity
412
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AB75998
ChemicalName: Methyl 6-bromo-7-chloro-8-methyl-4-hydroxyquinoline-2-carboxylate
CasNumber: 1065074-46-5
MolecularFormula: C12H9BrClNO3
MolecularWeight: 330.5618
MdlNumber: MFCD11053780
Smiles: COC(=O)c1cc(O)c2c(n1)c(C)c(c(c2)Br)Cl
Complexity: 412
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AB75998
ChemicalName:
Methyl 6-bromo-7-chloro-8-methyl-4-hydroxyquinoline-2-carboxylate
CasNumber:
1065074-46-5
MolecularFormula:
C12H9BrClNO3
MolecularWeight:
330.5618
MdlNumber:
MFCD11053780
Smiles:
COC(=O)c1cc(O)c2c(n1)c(C)c(c(c2)Br)Cl
Complexity:
412
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(nc1)Cl
Complexity: 151
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(nc1)Cl
Complexity:
151
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CO[C@H]1[C@@H](OC)O[C@@H]([C@@H]([C@@H]1OCc1ccccc1)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CO[C@H]1[C@@H](OC)O[C@@H]([C@@H]([C@@H]1OCc1ccccc1)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB76003
ChemicalName: Methyl 6-hydroxy-2-naphthoate
CasNumber: 17295-11-3
MolecularFormula: C12H10O3
MolecularWeight: 202.206
MdlNumber: MFCD00100526
Smiles: COC(=O)c1ccc2c(c1)ccc(c2)O
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB76003
ChemicalName:
Methyl 6-hydroxy-2-naphthoate
CasNumber:
17295-11-3
MolecularFormula:
C12H10O3
MolecularWeight:
202.206
MdlNumber:
MFCD00100526
Smiles:
COC(=O)c1ccc2c(c1)ccc(c2)O
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7