AB73823
720-01-4 | Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB73823
ChemicalName
Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate
CasNumber
720-01-4
MolecularFormula
C8H6ClF3N2O2
MolecularWeight
254.5936
MdlNumber
MFCD00173897
Smiles
CCOC(=O)c1cnc(nc1Cl)C(F)(F)F
Complexity
262
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AB73823
ChemicalName: Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate
CasNumber: 720-01-4
MolecularFormula: C8H6ClF3N2O2
MolecularWeight: 254.5936
MdlNumber: MFCD00173897
Smiles: CCOC(=O)c1cnc(nc1Cl)C(F)(F)F
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB73823
ChemicalName:
Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate
CasNumber:
720-01-4
MolecularFormula:
C8H6ClF3N2O2
MolecularWeight:
254.5936
MdlNumber:
MFCD00173897
Smiles:
CCOC(=O)c1cnc(nc1Cl)C(F)(F)F
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: AB73824
ChemicalName: Ethyl-4-chloroindole-2-carboxylate
CasNumber: 53590-46-8
MolecularFormula: C11H10ClNO2
MolecularWeight: 223.6556
MdlNumber: MFCD09264531
Smiles: CCOC(=O)c1cc2c([nH]1)cccc2Cl
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.8
CatalogNumber:
AB73824
ChemicalName:
Ethyl-4-chloroindole-2-carboxylate
CasNumber:
53590-46-8
MolecularFormula:
C11H10ClNO2
MolecularWeight:
223.6556
MdlNumber:
MFCD09264531
Smiles:
CCOC(=O)c1cc2c([nH]1)cccc2Cl
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(nc1Cl)N1CCOCC1
Complexity: 287
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc(nc1Cl)N1CCOCC1
Complexity:
287
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CCC(=O)Cl
Complexity: 133
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CCC(=O)Cl
Complexity:
133
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5