AB75955
1211589-41-1 | Methyl 5-bromo-2-(trifluoromethyl)pyridine-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75955
ChemicalName
Methyl 5-bromo-2-(trifluoromethyl)pyridine-4-carboxylate
CasNumber
1211589-41-1
MolecularFormula
C8H5BrF3NO2
MolecularWeight
284.03
MdlNumber
MFCD16657895
Smiles
COC(=O)c1cc(ncc1Br)C(F)(F)F
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AB75955
ChemicalName: Methyl 5-bromo-2-(trifluoromethyl)pyridine-4-carboxylate
CasNumber: 1211589-41-1
MolecularFormula: C8H5BrF3NO2
MolecularWeight: 284.03
MdlNumber: MFCD16657895
Smiles: COC(=O)c1cc(ncc1Br)C(F)(F)F
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB75955
ChemicalName:
Methyl 5-bromo-2-(trifluoromethyl)pyridine-4-carboxylate
CasNumber:
1211589-41-1
MolecularFormula:
C8H5BrF3NO2
MolecularWeight:
284.03
MdlNumber:
MFCD16657895
Smiles:
COC(=O)c1cc(ncc1Br)C(F)(F)F
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(Br)c(cc1OC)OC
Complexity: 222
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(Br)c(cc1OC)OC
Complexity:
222
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(=O)c1cc(Br)ccc1Cl
Complexity: 176
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(=O)c1cc(Br)ccc1Cl
Complexity:
176
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: AB75958
ChemicalName: Methyl 5-bromo-2-chloronicotinate
CasNumber: 78686-79-0
MolecularFormula: C7H5BrClNO2
MolecularWeight: 250.4771
MdlNumber: MFCD03844848
Smiles: COC(=O)c1cc(Br)cnc1Cl
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB75958
ChemicalName:
Methyl 5-bromo-2-chloronicotinate
CasNumber:
78686-79-0
MolecularFormula:
C7H5BrClNO2
MolecularWeight:
250.4771
MdlNumber:
MFCD03844848
Smiles:
COC(=O)c1cc(Br)cnc1Cl
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.4