AB54919
87269-87-2 | (S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AB54919
ChemicalName
(S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester, HCl
CasNumber
87269-87-2
MolecularFormula
C15H20ClNO2
MolecularWeight
281.7778
MdlNumber
MFCD04974076
Smiles
O=C([C@H]1N[C@@H]2[C@H](C1)CCC2)OCc1ccccc1.Cl
Complexity
299
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
3
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AB54919
ChemicalName: (S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester, HCl
CasNumber: 87269-87-2
MolecularFormula: C15H20ClNO2
MolecularWeight: 281.7778
MdlNumber: MFCD04974076
Smiles: O=C([C@H]1N[C@@H]2[C@H](C1)CCC2)OCc1ccccc1.Cl
Complexity: 299
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AB54919
ChemicalName:
(S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester, HCl
CasNumber:
87269-87-2
MolecularFormula:
C15H20ClNO2
MolecularWeight:
281.7778
MdlNumber:
MFCD04974076
Smiles:
O=C([C@H]1N[C@@H]2[C@H](C1)CCC2)OCc1ccccc1.Cl
Complexity:
299
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AB54920
ChemicalName: (2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
CasNumber: 80875-98-5
MolecularFormula: C9H15NO2
MolecularWeight: 169.2209
MdlNumber: MFCD07782125
Smiles: OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2
Complexity: 193
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AB54920
ChemicalName:
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid
CasNumber:
80875-98-5
MolecularFormula:
C9H15NO2
MolecularWeight:
169.2209
MdlNumber:
MFCD07782125
Smiles:
OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2
Complexity:
193
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C=C1)COCC2C(O2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C1=CC=C(C=C1)COCC2C(O2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB54922
ChemicalName: Benzyl (2s,3r)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate
CasNumber: 105228-46-4
MolecularFormula: C24H21NO4
MolecularWeight: 387.4278
MdlNumber: MFCD00074956
Smiles: O=C1O[C@@H](c2ccccc2)[C@H](N(C1)C(=O)OCc1ccccc1)c1ccccc1
Complexity: 547
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 5
CatalogNumber:
AB54922
ChemicalName:
Benzyl (2s,3r)-(+)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate
CasNumber:
105228-46-4
MolecularFormula:
C24H21NO4
MolecularWeight:
387.4278
MdlNumber:
MFCD00074956
Smiles:
O=C1O[C@@H](c2ccccc2)[C@H](N(C1)C(=O)OCc1ccccc1)c1ccccc1
Complexity:
547
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
5