AB08342
1988-11-0 | 2,6-Diisopropylcyclohexa-2,5-diene-1,4-dione
Manufacturer: A2B Chem
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CatalogNumber
AB08342
ChemicalName
2,6-Diisopropylcyclohexa-2,5-diene-1,4-dione
CasNumber
1988-11-0
MolecularFormula
C12H16O2
MolecularWeight
192.25424000000004
MdlNumber
MFCD18379392
Smiles
O=C1C=C(C(C)C)C(=O)C(=C1)C(C)C
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AB08342
ChemicalName: 2,6-Diisopropylcyclohexa-2,5-diene-1,4-dione
CasNumber: 1988-11-0
MolecularFormula: C12H16O2
MolecularWeight: 192.25424000000004
MdlNumber: MFCD18379392
Smiles: O=C1C=C(C(C)C)C(=O)C(=C1)C(C)C
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB08342
ChemicalName:
2,6-Diisopropylcyclohexa-2,5-diene-1,4-dione
CasNumber:
1988-11-0
MolecularFormula:
C12H16O2
MolecularWeight:
192.25424000000004
MdlNumber:
MFCD18379392
Smiles:
O=C1C=C(C(C)C)C(=O)C(=C1)C(C)C
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: AB08343
ChemicalName: tert-Butyl 5-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber: 198835-06-2
MolecularFormula: C11H17NO3
MolecularWeight: 211.2576
MdlNumber: MFCD09040745
Smiles: O=C1CC2CC1CN2C(=O)OC(C)(C)C
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB08343
ChemicalName:
tert-Butyl 5-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber:
198835-06-2
MolecularFormula:
C11H17NO3
MolecularWeight:
211.2576
MdlNumber:
MFCD09040745
Smiles:
O=C1CC2CC1CN2C(=O)OC(C)(C)C
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@H]1C[C@@H]2C[C@H]1N(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@H]1C[C@@H]2C[C@H]1N(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB08345
ChemicalName: tert-Butyl 6-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber: 198835-04-0
MolecularFormula: C11H17NO3
MolecularWeight: 211.2575800000001
MdlNumber: MFCD09040748
Smiles: O=C(N1CC2CC1C(=O)C2)OC(C)(C)C
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AB08345
ChemicalName:
tert-Butyl 6-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate
CasNumber:
198835-04-0
MolecularFormula:
C11H17NO3
MolecularWeight:
211.2575800000001
MdlNumber:
MFCD09040748
Smiles:
O=C(N1CC2CC1C(=O)C2)OC(C)(C)C
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.1