AD73549
135908-33-7 | 4-Aminobicyclo[2.2.2]octane-1-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD73549
ChemicalName
4-Aminobicyclo[2.2.2]octane-1-carboxylic acid methyl ester
CasNumber
135908-33-7
MolecularFormula
C10H17NO2
MolecularWeight
183.2475
MdlNumber
MFCD20693756
Smiles
COC(=O)C12CCC(CC1)(CC2)N
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AD73549
ChemicalName: 4-Aminobicyclo[2.2.2]octane-1-carboxylic acid methyl ester
CasNumber: 135908-33-7
MolecularFormula: C10H17NO2
MolecularWeight: 183.2475
MdlNumber: MFCD20693756
Smiles: COC(=O)C12CCC(CC1)(CC2)N
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AD73549
ChemicalName:
4-Aminobicyclo[2.2.2]octane-1-carboxylic acid methyl ester
CasNumber:
135908-33-7
MolecularFormula:
C10H17NO2
MolecularWeight:
183.2475
MdlNumber:
MFCD20693756
Smiles:
COC(=O)C12CCC(CC1)(CC2)N
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: C=COCCCCOC(=O)CCCCC(=O)OCCCCOC=C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
C=COCCCCOC(=O)CCCCC(=O)OCCCCOC=C
Complexity:
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Smiles: C1CC[NH+](CC1)CC1COc2c(O1)cccc2.[Cl-]
Complexity: __
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Smiles:
C1CC[NH+](CC1)CC1COc2c(O1)cccc2.[Cl-]
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: O=CC[C@@H](c1ccccc1)NC(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=CC[C@@H](c1ccccc1)NC(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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