AI39017
1714144-91-8 | Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate dihydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AI39017
ChemicalName
Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate dihydrochloride
CasNumber
1714144-91-8
MolecularFormula
C17H25ClN2O2
MolecularWeight
324.8456
MdlNumber
MFCD28992067
Smiles
O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1.Cl
Complexity
347
Covalently-bondedUnitCount
2
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AI39017
ChemicalName: Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate dihydrochloride
CasNumber: 1714144-91-8
MolecularFormula: C17H25ClN2O2
MolecularWeight: 324.8456
MdlNumber: MFCD28992067
Smiles: O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1.Cl
Complexity: 347
Covalently-bondedUnitCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AI39017
ChemicalName:
Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate dihydrochloride
CasNumber:
1714144-91-8
MolecularFormula:
C17H25ClN2O2
MolecularWeight:
324.8456
MdlNumber:
MFCD28992067
Smiles:
O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1.Cl
Complexity:
347
Covalently-bondedUnitCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
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Smiles: CC1(N)COC2(OC1)CCCCC2
Complexity: __
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Smiles:
CC1(N)COC2(OC1)CCCCC2
Complexity:
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Smiles: Fc1ccc(cc1)[C@@H]1NCCO[C@@H]1O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C.Cl
Complexity: __
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Smiles:
Fc1ccc(cc1)[C@@H]1NCCO[C@@H]1O[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C.Cl
Complexity:
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Smiles: [O-]C(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1C2CCC2=CC(=O)C=C[C@]12C.[Na+]
Complexity: __
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RotatableBondCount: __
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
[O-]C(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1C2CCC2=CC(=O)C=C[C@]12C.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__