AB49543
387827-64-7 | 2-(2,4-Difluorophenyl)-5-(trifluoromethyl)pyridine
Manufacturer: A2B Chem
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CatalogNumber
AB49543
ChemicalName
2-(2,4-Difluorophenyl)-5-(trifluoromethyl)pyridine
CasNumber
387827-64-7
MolecularFormula
C12H6F5N
MolecularWeight
259.1748
MdlNumber
MFCD28144542
Smiles
Fc1ccc(c(c1)F)c1ccc(cn1)C(F)(F)F
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
6
RotatableBondCount
1
Xlogp3
3.6
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CatalogNumber: AB49543
ChemicalName: 2-(2,4-Difluorophenyl)-5-(trifluoromethyl)pyridine
CasNumber: 387827-64-7
MolecularFormula: C12H6F5N
MolecularWeight: 259.1748
MdlNumber: MFCD28144542
Smiles: Fc1ccc(c(c1)F)c1ccc(cn1)C(F)(F)F
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AB49543
ChemicalName:
2-(2,4-Difluorophenyl)-5-(trifluoromethyl)pyridine
CasNumber:
387827-64-7
MolecularFormula:
C12H6F5N
MolecularWeight:
259.1748
MdlNumber:
MFCD28144542
Smiles:
Fc1ccc(c(c1)F)c1ccc(cn1)C(F)(F)F
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNC1CCOCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNC1CCOCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB49545
ChemicalName: Methyl 4-bromo-1-methyl-1h-pyrazole-3-carboxylate
CasNumber: 211738-66-8
MolecularFormula: C6H7BrN2O2
MolecularWeight: 219.036
MdlNumber: MFCD02253785
Smiles: COC(=O)c1nn(cc1Br)C
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AB49545
ChemicalName:
Methyl 4-bromo-1-methyl-1h-pyrazole-3-carboxylate
CasNumber:
211738-66-8
MolecularFormula:
C6H7BrN2O2
MolecularWeight:
219.036
MdlNumber:
MFCD02253785
Smiles:
COC(=O)c1nn(cc1Br)C
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.1
CatalogNumber: AB49546
ChemicalName: 3,4-Dihydro-1(2H)-isoquinolinone-6-boronic acid pinacol ester
CasNumber: 376584-30-4
MolecularFormula: C15H20BNO3
MolecularWeight: 273.1352
MdlNumber: MFCD11044671
Smiles: O=C1NCCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity: 394
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB49546
ChemicalName:
3,4-Dihydro-1(2H)-isoquinolinone-6-boronic acid pinacol ester
CasNumber:
376584-30-4
MolecularFormula:
C15H20BNO3
MolecularWeight:
273.1352
MdlNumber:
MFCD11044671
Smiles:
O=C1NCCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
394
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
__