AB45627
57346-05-1 | Bicyclo[2.2.2]octane-2,5-dione
Manufacturer: A2B Chem
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CatalogNumber
AB45627
ChemicalName
Bicyclo[2.2.2]octane-2,5-dione
CasNumber
57346-05-1
MolecularFormula
C8H10O2
MolecularWeight
138.1638
MdlNumber
MFCD24504367
Smiles
O=C1CC2CCC1CC2=O
Complexity
173
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
-0.1
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CatalogNumber: AB45627
ChemicalName: Bicyclo[2.2.2]octane-2,5-dione
CasNumber: 57346-05-1
MolecularFormula: C8H10O2
MolecularWeight: 138.1638
MdlNumber: MFCD24504367
Smiles: O=C1CC2CCC1CC2=O
Complexity: 173
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: -0.1
CatalogNumber:
AB45627
ChemicalName:
Bicyclo[2.2.2]octane-2,5-dione
CasNumber:
57346-05-1
MolecularFormula:
C8H10O2
MolecularWeight:
138.1638
MdlNumber:
MFCD24504367
Smiles:
O=C1CC2CCC1CC2=O
Complexity:
173
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)c1cc(cc(c1)C(=O)O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(cc(c1)C(=O)O)c1cc(cc(c1)C(=O)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cccc(c1)c1ccccc1)O
Complexity: 190
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cccc(c1)c1ccccc1)O
Complexity:
190
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc(c1)c1ccccc1
Complexity: 219
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 3.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(c1)c1ccccc1
Complexity:
219
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.5