AB45890
762-21-0 | Diethyl acetylenedicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB45890
ChemicalName
Diethyl acetylenedicarboxylate
CasNumber
762-21-0
MolecularFormula
C8H10O4
MolecularWeight
170.1626
MdlNumber
MFCD00009186
Smiles
CCOC(=O)C#CC(=O)OCC
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
1.5
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CatalogNumber: AB45890
ChemicalName: Diethyl acetylenedicarboxylate
CasNumber: 762-21-0
MolecularFormula: C8H10O4
MolecularWeight: 170.1626
MdlNumber: MFCD00009186
Smiles: CCOC(=O)C#CC(=O)OCC
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.5
CatalogNumber:
AB45890
ChemicalName:
Diethyl acetylenedicarboxylate
CasNumber:
762-21-0
MolecularFormula:
C8H10O4
MolecularWeight:
170.1626
MdlNumber:
MFCD00009186
Smiles:
CCOC(=O)C#CC(=O)OCC
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.5
CatalogNumber: AB45891
ChemicalName: Diethyl acetylmalonate
CasNumber: 570-08-1
MolecularFormula: C9H14O5
MolecularWeight: 202.2045
MdlNumber: MFCD00026876
Smiles: CCOC(=O)C(C(=O)OCC)C(=O)C
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 7
Xlogp3: 0.8
CatalogNumber:
AB45891
ChemicalName:
Diethyl acetylmalonate
CasNumber:
570-08-1
MolecularFormula:
C9H14O5
MolecularWeight:
202.2045
MdlNumber:
MFCD00026876
Smiles:
CCOC(=O)C(C(=O)OCC)C(=O)C
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
7
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(C(=O)OCC)N.Cl
Complexity: 151
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(C(=O)OCC)N.Cl
Complexity:
151
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOP(=O)(C(Br)(F)F)OCC
Complexity: 178
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOP(=O)(C(Br)(F)F)OCC
Complexity:
178
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8