AB76019
1133116-01-4 | Methyl 8-bromo-6-chloro-4-hydroxyquinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB76019
ChemicalName
Methyl 8-bromo-6-chloro-4-hydroxyquinoline-2-carboxylate
CasNumber
1133116-01-4
MolecularFormula
C11H7BrClNO3
MolecularWeight
316.5352
MdlNumber
MFCD11855927
Smiles
COC(=O)c1cc(O)c2c(n1)c(Br)cc(c2)Cl
Complexity
385
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.9
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CatalogNumber: AB76019
ChemicalName: Methyl 8-bromo-6-chloro-4-hydroxyquinoline-2-carboxylate
CasNumber: 1133116-01-4
MolecularFormula: C11H7BrClNO3
MolecularWeight: 316.5352
MdlNumber: MFCD11855927
Smiles: COC(=O)c1cc(O)c2c(n1)c(Br)cc(c2)Cl
Complexity: 385
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AB76019
ChemicalName:
Methyl 8-bromo-6-chloro-4-hydroxyquinoline-2-carboxylate
CasNumber:
1133116-01-4
MolecularFormula:
C11H7BrClNO3
MolecularWeight:
316.5352
MdlNumber:
MFCD11855927
Smiles:
COC(=O)c1cc(O)c2c(n1)c(Br)cc(c2)Cl
Complexity:
385
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
CatalogNumber: AB76020
ChemicalName: Methyl 8-bromo-6-fluoro-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber: 442549-68-0
MolecularFormula: C11H7BrFNO3
MolecularWeight: 300.0806
MdlNumber: MFCD11053778
Smiles: COC(=O)c1cc(=O)c2c([nH]1)c(Br)cc(c2)F
Complexity: 385
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB76020
ChemicalName:
Methyl 8-bromo-6-fluoro-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber:
442549-68-0
MolecularFormula:
C11H7BrFNO3
MolecularWeight:
300.0806
MdlNumber:
MFCD11053778
Smiles:
COC(=O)c1cc(=O)c2c([nH]1)c(Br)cc(c2)F
Complexity:
385
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AB76021
ChemicalName: Methyl 8-chloro-4-hydroxyquinoline-2-carboxylate
CasNumber: 1065074-57-8
MolecularFormula: C11H8ClNO3
MolecularWeight: 237.6391
MdlNumber: MFCD11053822
Smiles: COC(=O)c1cc(O)c2c(n1)c(Cl)ccc2
Complexity: 353
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AB76021
ChemicalName:
Methyl 8-chloro-4-hydroxyquinoline-2-carboxylate
CasNumber:
1065074-57-8
MolecularFormula:
C11H8ClNO3
MolecularWeight:
237.6391
MdlNumber:
MFCD11053822
Smiles:
COC(=O)c1cc(O)c2c(n1)c(Cl)ccc2
Complexity:
353
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
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Smiles: COC(=O)CCCCCCC(=O)Cl
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Smiles:
COC(=O)CCCCCCC(=O)Cl
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HydrogenBondDonorCount:
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