AA52919
1214385-66-6 | Methyl 2-bromo-3-fluoroisonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AA52919
ChemicalName
Methyl 2-bromo-3-fluoroisonicotinate
CasNumber
1214385-66-6
MolecularFormula
C7H5BrFNO2
MolecularWeight
234.0225
MdlNumber
MFCD14698109
Smiles
COC(=O)c1ccnc(c1F)Br
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AA52919
ChemicalName: Methyl 2-bromo-3-fluoroisonicotinate
CasNumber: 1214385-66-6
MolecularFormula: C7H5BrFNO2
MolecularWeight: 234.0225
MdlNumber: MFCD14698109
Smiles: COC(=O)c1ccnc(c1F)Br
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AA52919
ChemicalName:
Methyl 2-bromo-3-fluoroisonicotinate
CasNumber:
1214385-66-6
MolecularFormula:
C7H5BrFNO2
MolecularWeight:
234.0225
MdlNumber:
MFCD14698109
Smiles:
COC(=O)c1ccnc(c1F)Br
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(c(c1)C(F)(F)F)F
Complexity: 152
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(c(c1)C(F)(F)F)F
Complexity:
152
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1cc2c(cc1OCC)CCN(C2C(=O)[O-])C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOc1cc2c(cc1OCC)CCN(C2C(=O)[O-])C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: NNC(=O)CCCC[C@@H]1SCC2C1NC(=O)N2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NNC(=O)CCCC[C@@H]1SCC2C1NC(=O)N2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__