AB75992
221313-10-6 | Methyl 6-(trifluoromethyl)nicotinate
Manufacturer: A2B Chem
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CatalogNumber
AB75992
ChemicalName
Methyl 6-(trifluoromethyl)nicotinate
CasNumber
221313-10-6
MolecularFormula
C8H6F3NO2
MolecularWeight
205.13394959999997
MdlNumber
MFCD03001346
Smiles
COC(=O)c1ccc(nc1)C(F)(F)F
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB75992
ChemicalName: Methyl 6-(trifluoromethyl)nicotinate
CasNumber: 221313-10-6
MolecularFormula: C8H6F3NO2
MolecularWeight: 205.13394959999997
MdlNumber: MFCD03001346
Smiles: COC(=O)c1ccc(nc1)C(F)(F)F
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB75992
ChemicalName:
Methyl 6-(trifluoromethyl)nicotinate
CasNumber:
221313-10-6
MolecularFormula:
C8H6F3NO2
MolecularWeight:
205.13394959999997
MdlNumber:
MFCD03001346
Smiles:
COC(=O)c1ccc(nc1)C(F)(F)F
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: AB75993
ChemicalName: Methyl 6-acetamido-4-hydroxyquinoline-2-carboxylate
CasNumber: 929028-74-0
MolecularFormula: C13H12N2O4
MolecularWeight: 260.2454
MdlNumber: MFCD11855916
Smiles: COC(=O)c1cc(O)c2c(n1)ccc(c2)NC(=O)C
Complexity: 444
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 0.8
CatalogNumber:
AB75993
ChemicalName:
Methyl 6-acetamido-4-hydroxyquinoline-2-carboxylate
CasNumber:
929028-74-0
MolecularFormula:
C13H12N2O4
MolecularWeight:
260.2454
MdlNumber:
MFCD11855916
Smiles:
COC(=O)c1cc(O)c2c(n1)ccc(c2)NC(=O)C
Complexity:
444
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
0.8
CatalogNumber: AB75994
ChemicalName: Methyl 6-amino-3,5-dibromopicolinate
CasNumber: 443956-21-6
MolecularFormula: C7H6Br2N2O2
MolecularWeight: 309.9427
MdlNumber: MFCD13195771
Smiles: COC(=O)c1nc(N)c(cc1Br)Br
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB75994
ChemicalName:
Methyl 6-amino-3,5-dibromopicolinate
CasNumber:
443956-21-6
MolecularFormula:
C7H6Br2N2O2
MolecularWeight:
309.9427
MdlNumber:
MFCD13195771
Smiles:
COC(=O)c1nc(N)c(cc1Br)Br
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.1
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Smiles: COC(=O)c1cc(N)cc2c1cc[nH]2
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COC(=O)c1cc(N)cc2c1cc[nH]2
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