AA92719
174498-06-7 | Propane-1,3-diyl bis(3-oxobutanoate)
Manufacturer: A2B Chem
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CatalogNumber
AA92719
ChemicalName
Propane-1,3-diyl bis(3-oxobutanoate)
CasNumber
174498-06-7
MolecularFormula
C11H16O6
MolecularWeight
244.2411
MdlNumber
MFCD30478686
Smiles
O=C(CC(=O)C)OCCCOC(=O)CC(=O)C
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
RotatableBondCount
10
Xlogp3
0.1
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CatalogNumber: AA92719
ChemicalName: Propane-1,3-diyl bis(3-oxobutanoate)
CasNumber: 174498-06-7
MolecularFormula: C11H16O6
MolecularWeight: 244.2411
MdlNumber: MFCD30478686
Smiles: O=C(CC(=O)C)OCCCOC(=O)CC(=O)C
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
RotatableBondCount: 10
Xlogp3: 0.1
CatalogNumber:
AA92719
ChemicalName:
Propane-1,3-diyl bis(3-oxobutanoate)
CasNumber:
174498-06-7
MolecularFormula:
C11H16O6
MolecularWeight:
244.2411
MdlNumber:
MFCD30478686
Smiles:
O=C(CC(=O)C)OCCCOC(=O)CC(=O)C
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
RotatableBondCount:
10
Xlogp3:
0.1
CatalogNumber: AA92720
ChemicalName: Ethyl 4-chloronicotinate hydrochloride
CasNumber: 174496-99-2
MolecularFormula: C8H9Cl2NO2
MolecularWeight: 222.06855999999996
MdlNumber: MFCD06804523
Smiles: CCOC(=O)c1cnccc1Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AA92720
ChemicalName:
Ethyl 4-chloronicotinate hydrochloride
CasNumber:
174496-99-2
MolecularFormula:
C8H9Cl2NO2
MolecularWeight:
222.06855999999996
MdlNumber:
MFCD06804523
Smiles:
CCOC(=O)c1cnccc1Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(COc1ccc(cc1)N)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(COc1ccc(cc1)N)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA92725
ChemicalName: tert-Butyl 3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate
CasNumber: 174486-93-2
MolecularFormula: C12H22N2O2
MolecularWeight: 226.3153
MdlNumber: MFCD11045781
Smiles: NC1CC2CCC(C1)N2C(=O)OC(C)(C)C
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AA92725
ChemicalName:
tert-Butyl 3-amino-8-azabicyclo[3.2.1]octane-8-carboxylate
CasNumber:
174486-93-2
MolecularFormula:
C12H22N2O2
MolecularWeight:
226.3153
MdlNumber:
MFCD11045781
Smiles:
NC1CC2CCC(C1)N2C(=O)OC(C)(C)C
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.3