AA21960
115913-32-1 | Dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA21960
ChemicalName
Dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
CasNumber
115913-32-1
MolecularFormula
C9H12O4
MolecularWeight
184.18918000000002
MdlNumber
MFCD23106317
Smiles
COC(=O)C12CC(C1)(C2)C(=O)OC
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
0.2
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CatalogNumber: AA21960
ChemicalName: Dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
CasNumber: 115913-32-1
MolecularFormula: C9H12O4
MolecularWeight: 184.18918000000002
MdlNumber: MFCD23106317
Smiles: COC(=O)C12CC(C1)(C2)C(=O)OC
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 0.2
CatalogNumber:
AA21960
ChemicalName:
Dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
CasNumber:
115913-32-1
MolecularFormula:
C9H12O4
MolecularWeight:
184.18918000000002
MdlNumber:
MFCD23106317
Smiles:
COC(=O)C12CC(C1)(C2)C(=O)OC
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC(=O)C12CC(C1)(C2)C(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)C12CC(C1)(C2)C(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA21962
ChemicalName: 1,1'-(Bicyclo[1.1.1]pentane-1,3-diyl)diethanone
CasNumber: 115913-30-9
MolecularFormula: C9H12O2
MolecularWeight: 152.19038
MdlNumber: MFCD23164149
Smiles: CC(=O)C12CC(C1)(C2)C(=O)C
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: -0.1
CatalogNumber:
AA21962
ChemicalName:
1,1'-(Bicyclo[1.1.1]pentane-1,3-diyl)diethanone
CasNumber:
115913-30-9
MolecularFormula:
C9H12O2
MolecularWeight:
152.19038
MdlNumber:
MFCD23164149
Smiles:
CC(=O)C12CC(C1)(C2)C(=O)C
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)NC(OC(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)NC(OC(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__