AI50912
478837-18-2 | tert-Butyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI50912
ChemicalName
tert-Butyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CasNumber
478837-18-2
MolecularFormula
C12H21NO3
MolecularWeight
227.3
MdlNumber
MFCD13568915
Smiles
OC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
1.6
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CatalogNumber: AI50912
ChemicalName: tert-Butyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CasNumber: 478837-18-2
MolecularFormula: C12H21NO3
MolecularWeight: 227.3
MdlNumber: MFCD13568915
Smiles: OC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.6
CatalogNumber:
AI50912
ChemicalName:
tert-Butyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CasNumber:
478837-18-2
MolecularFormula:
C12H21NO3
MolecularWeight:
227.3
MdlNumber:
MFCD13568915
Smiles:
OC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC1C[C@@H]2CC[C@H](C1)N2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC1C[C@@H]2CC[C@H](C1)N2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1c(CCN)c2c([nH]1)ccc(c2)Br.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1c(CCN)c2c([nH]1)ccc(c2)Br.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI50915
ChemicalName: 4-(Pyrrolidinocarbonyl)phenol
CasNumber: 478929-28-1
MolecularFormula: C11H13NO2
MolecularWeight: 191.2264
MdlNumber: MFCD07633880
Smiles: O=C(c1ccc(cc1)O)N1CCCC1
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 1.5
CatalogNumber:
AI50915
ChemicalName:
4-(Pyrrolidinocarbonyl)phenol
CasNumber:
478929-28-1
MolecularFormula:
C11H13NO2
MolecularWeight:
191.2264
MdlNumber:
MFCD07633880
Smiles:
O=C(c1ccc(cc1)O)N1CCCC1
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.5