AI35867
1445951-01-8 | tert-Butyl 1-(hydroxymethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI35867
ChemicalName
tert-Butyl 1-(hydroxymethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
CasNumber
1445951-01-8
MolecularFormula
C11H19NO3
MolecularWeight
213.2735
MdlNumber
MFCD25509348
Smiles
OCC12CC1CCN2C(=O)OC(C)(C)C
Complexity
284
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
2
Xlogp3
0.8
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CatalogNumber: AI35867
ChemicalName: tert-Butyl 1-(hydroxymethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
CasNumber: 1445951-01-8
MolecularFormula: C11H19NO3
MolecularWeight: 213.2735
MdlNumber: MFCD25509348
Smiles: OCC12CC1CCN2C(=O)OC(C)(C)C
Complexity: 284
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.8
CatalogNumber:
AI35867
ChemicalName:
tert-Butyl 1-(hydroxymethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
CasNumber:
1445951-01-8
MolecularFormula:
C11H19NO3
MolecularWeight:
213.2735
MdlNumber:
MFCD25509348
Smiles:
OCC12CC1CCN2C(=O)OC(C)(C)C
Complexity:
284
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.8
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Smiles: Clc1nccc(c1)C1N(CCCc2c1cccc2)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
Clc1nccc(c1)C1N(CCCc2c1cccc2)C(=O)OC(C)(C)C
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Smiles: O[C@H]1CCN([C@H]2[C@@H]1CN(C2)Cc1ccccc1)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
O[C@H]1CCN([C@H]2[C@@H]1CN(C2)Cc1ccccc1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: IC[C@H]1O[C@H]2[C@@H](C1)CN(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
IC[C@H]1O[C@H]2[C@@H](C1)CN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__