AB44321
5231-87-8 | 3,4-Diethoxy-3-cyclobutene-1,2-dione
Manufacturer: A2B Chem
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CatalogNumber
AB44321
ChemicalName
3,4-Diethoxy-3-cyclobutene-1,2-dione
CasNumber
5231-87-8
MolecularFormula
C8H10O4
MolecularWeight
170.1626
MdlNumber
MFCD00001333
Smiles
CCOC1=C(C(=O)C1=O)OCC
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
0.7
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CatalogNumber: AB44321
ChemicalName: 3,4-Diethoxy-3-cyclobutene-1,2-dione
CasNumber: 5231-87-8
MolecularFormula: C8H10O4
MolecularWeight: 170.1626
MdlNumber: MFCD00001333
Smiles: CCOC1=C(C(=O)C1=O)OCC
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 0.7
CatalogNumber:
AB44321
ChemicalName:
3,4-Diethoxy-3-cyclobutene-1,2-dione
CasNumber:
5231-87-8
MolecularFormula:
C8H10O4
MolecularWeight:
170.1626
MdlNumber:
MFCD00001333
Smiles:
CCOC1=C(C(=O)C1=O)OCC
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(c(c1)F)F
Complexity: 97.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(c(c1)F)F
Complexity:
97.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1ccc(c(c1)F)F
Complexity: 172
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1ccc(c(c1)F)F
Complexity:
172
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Sc1ccc(c(c1)F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Sc1ccc(c(c1)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__