AB75876
1133115-62-4 | Methyl 4-chloro-8-(trifluoromethyl)quinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75876
ChemicalName
Methyl 4-chloro-8-(trifluoromethyl)quinoline-2-carboxylate
CasNumber
1133115-62-4
MolecularFormula
C12H7ClF3NO2
MolecularWeight
289.6377
MdlNumber
MFCD11855877
Smiles
COC(=O)c1cc(Cl)c2c(n1)c(ccc2)C(F)(F)F
Complexity
350
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
3.9
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CatalogNumber: AB75876
ChemicalName: Methyl 4-chloro-8-(trifluoromethyl)quinoline-2-carboxylate
CasNumber: 1133115-62-4
MolecularFormula: C12H7ClF3NO2
MolecularWeight: 289.6377
MdlNumber: MFCD11855877
Smiles: COC(=O)c1cc(Cl)c2c(n1)c(ccc2)C(F)(F)F
Complexity: 350
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 3.9
CatalogNumber:
AB75876
ChemicalName:
Methyl 4-chloro-8-(trifluoromethyl)quinoline-2-carboxylate
CasNumber:
1133115-62-4
MolecularFormula:
C12H7ClF3NO2
MolecularWeight:
289.6377
MdlNumber:
MFCD11855877
Smiles:
COC(=O)c1cc(Cl)c2c(n1)c(ccc2)C(F)(F)F
Complexity:
350
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)C(=O)Cl
Complexity: 207
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)C(=O)Cl
Complexity:
207
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H](Cc1ccc(cc1)Cl)N.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)[C@@H](Cc1ccc(cc1)Cl)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularWeight: __
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Smiles: N#CCCCC(=O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCCCC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__