AI51828
52718-95-3 | Methyl 2-bromonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AI51828
ChemicalName
Methyl 2-bromonicotinate
CasNumber
52718-95-3
MolecularFormula
C7H6BrNO2
MolecularWeight
216.032
MdlNumber
MFCD07367915
Smiles
COC(=O)c1cccnc1Br
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AI51828
ChemicalName: Methyl 2-bromonicotinate
CasNumber: 52718-95-3
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD07367915
Smiles: COC(=O)c1cccnc1Br
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AI51828
ChemicalName:
Methyl 2-bromonicotinate
CasNumber:
52718-95-3
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD07367915
Smiles:
COC(=O)c1cccnc1Br
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H]1[C@H]2C[C@H]3C1C3C2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H]1[C@H]2C[C@H]3C1C3C2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1)n1cnc(n1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)n1cnc(n1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI51831
ChemicalName: 3-Nitrosalicylaldehyde
CasNumber: 5274-70-4
MolecularFormula: C7H5NO4
MolecularWeight: 167.1189
MdlNumber: MFCD00041874
Smiles: O=Cc1cccc(c1O)[N+](=O)[O-]
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AI51831
ChemicalName:
3-Nitrosalicylaldehyde
CasNumber:
5274-70-4
MolecularFormula:
C7H5NO4
MolecularWeight:
167.1189
MdlNumber:
MFCD00041874
Smiles:
O=Cc1cccc(c1O)[N+](=O)[O-]
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1