AB05781
2050-23-9 | Diethyl suberate
Manufacturer: A2B Chem
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CatalogNumber
AB05781
ChemicalName
Diethyl suberate
CasNumber
2050-23-9
MolecularFormula
C12H22O4
MolecularWeight
230.3007
MdlNumber
MFCD00009217
Smiles
CCOC(=O)CCCCCCC(=O)OCC
NscNumber
62701
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
11
Xlogp3
2.4
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CatalogNumber: AB05781
ChemicalName: Diethyl suberate
CasNumber: 2050-23-9
MolecularFormula: C12H22O4
MolecularWeight: 230.3007
MdlNumber: MFCD00009217
Smiles: CCOC(=O)CCCCCCC(=O)OCC
NscNumber: 62701
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 11
Xlogp3: 2.4
CatalogNumber:
AB05781
ChemicalName:
Diethyl suberate
CasNumber:
2050-23-9
MolecularFormula:
C12H22O4
MolecularWeight:
230.3007
MdlNumber:
MFCD00009217
Smiles:
CCOC(=O)CCCCCCC(=O)OCC
NscNumber:
62701
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
11
Xlogp3:
2.4
CatalogNumber: AB05782
ChemicalName: Diethyl pyridine-2,3-dicarboxylate
CasNumber: 2050-22-8
MolecularFormula: C11H13NO4
MolecularWeight: 223.2252
MdlNumber: MFCD08689697
Smiles: CCOC(=O)c1ncccc1C(=O)OCC
NscNumber: __
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 1.6
CatalogNumber:
AB05782
ChemicalName:
Diethyl pyridine-2,3-dicarboxylate
CasNumber:
2050-22-8
MolecularFormula:
C11H13NO4
MolecularWeight:
223.2252
MdlNumber:
MFCD08689697
Smiles:
CCOC(=O)c1ncccc1C(=O)OCC
NscNumber:
__
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CCCCCC(=O)OCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CCCCCC(=O)OCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cc(ccc1C(=O)OCC)[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cc(ccc1C(=O)OCC)[N+](=O)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__