AB76016
1133115-52-2 | Methyl 8-bromo-4-chloro-5-fluoroquinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB76016
ChemicalName
Methyl 8-bromo-4-chloro-5-fluoroquinoline-2-carboxylate
CasNumber
1133115-52-2
MolecularFormula
C11H6BrClFNO2
MolecularWeight
318.5262
MdlNumber
MFCD11855872
Smiles
COC(=O)c1cc(Cl)c2c(n1)c(Br)ccc2F
Complexity
307
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AB76016
ChemicalName: Methyl 8-bromo-4-chloro-5-fluoroquinoline-2-carboxylate
CasNumber: 1133115-52-2
MolecularFormula: C11H6BrClFNO2
MolecularWeight: 318.5262
MdlNumber: MFCD11855872
Smiles: COC(=O)c1cc(Cl)c2c(n1)c(Br)ccc2F
Complexity: 307
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AB76016
ChemicalName:
Methyl 8-bromo-4-chloro-5-fluoroquinoline-2-carboxylate
CasNumber:
1133115-52-2
MolecularFormula:
C11H6BrClFNO2
MolecularWeight:
318.5262
MdlNumber:
MFCD11855872
Smiles:
COC(=O)c1cc(Cl)c2c(n1)c(Br)ccc2F
Complexity:
307
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.8
CatalogNumber: AB76017
ChemicalName: Methyl 8-bromo-4-hydroxy-5-trifluoromethylquinoline-2-carboxylate
CasNumber: 1072944-77-4
MolecularFormula: C12H7BrF3NO3
MolecularWeight: 350.0881
MdlNumber: MFCD11504926
Smiles: COC(=O)c1cc(O)c2c(n1)c(Br)ccc2C(F)(F)F
Complexity: 463
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AB76017
ChemicalName:
Methyl 8-bromo-4-hydroxy-5-trifluoromethylquinoline-2-carboxylate
CasNumber:
1072944-77-4
MolecularFormula:
C12H7BrF3NO3
MolecularWeight:
350.0881
MdlNumber:
MFCD11504926
Smiles:
COC(=O)c1cc(O)c2c(n1)c(Br)ccc2C(F)(F)F
Complexity:
463
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(O)c2c(n1)c(Br)ccc2F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1cc(O)c2c(n1)c(Br)ccc2F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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
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
RotatableBondCount:
2
Xlogp3:
2.9