AA90034
1678-52-0 | Diethyl pyridine-3,4-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA90034
ChemicalName
Diethyl pyridine-3,4-dicarboxylate
CasNumber
1678-52-0
MolecularFormula
C11H13NO4
MolecularWeight
223.2252
MdlNumber
MFCD00012349
Smiles
CCOC(=O)c1cnccc1C(=O)OCC
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
6
Xlogp3
1.3
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CatalogNumber: AA90034
ChemicalName: Diethyl pyridine-3,4-dicarboxylate
CasNumber: 1678-52-0
MolecularFormula: C11H13NO4
MolecularWeight: 223.2252
MdlNumber: MFCD00012349
Smiles: CCOC(=O)c1cnccc1C(=O)OCC
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 1.3
CatalogNumber:
AA90034
ChemicalName:
Diethyl pyridine-3,4-dicarboxylate
CasNumber:
1678-52-0
MolecularFormula:
C11H13NO4
MolecularWeight:
223.2252
MdlNumber:
MFCD00012349
Smiles:
CCOC(=O)c1cnccc1C(=O)OCC
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
1.3
CatalogNumber: AA90035
ChemicalName: 3-Bromo-4-nitropyridine N-oxide
CasNumber: 1678-49-5
MolecularFormula: C5H3BrN2O3
MolecularWeight: 218.9929
MdlNumber: MFCD00075528
Smiles: [O-][n+]1ccc(c(c1)Br)[N+](=O)[O-]
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 0.4
CatalogNumber:
AA90035
ChemicalName:
3-Bromo-4-nitropyridine N-oxide
CasNumber:
1678-49-5
MolecularFormula:
C5H3BrN2O3
MolecularWeight:
218.9929
MdlNumber:
MFCD00075528
Smiles:
[O-][n+]1ccc(c(c1)Br)[N+](=O)[O-]
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCC(=O)OC(CO)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCC(=O)OC(CO)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(cc1)S(=O)(=O)OC(C(=O)c1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)S(=O)(=O)OC(C(=O)c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__