AA69871
142253-50-7 | (S)-tert-Butyl 2-(cyanomethyl)pyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA69871
ChemicalName
(S)-tert-Butyl 2-(cyanomethyl)pyrrolidine-1-carboxylate
CasNumber
142253-50-7
MolecularFormula
C11H18N2O2
MolecularWeight
210.2728
MdlNumber
MFCD03094801
Smiles
N#CC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity
285
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AA69871
ChemicalName: (S)-tert-Butyl 2-(cyanomethyl)pyrrolidine-1-carboxylate
CasNumber: 142253-50-7
MolecularFormula: C11H18N2O2
MolecularWeight: 210.2728
MdlNumber: MFCD03094801
Smiles: N#CC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity: 285
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AA69871
ChemicalName:
(S)-tert-Butyl 2-(cyanomethyl)pyrrolidine-1-carboxylate
CasNumber:
142253-50-7
MolecularFormula:
C11H18N2O2
MolecularWeight:
210.2728
MdlNumber:
MFCD03094801
Smiles:
N#CC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity:
285
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
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Smiles: N#CCC1CCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularWeight:
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Smiles:
N#CCC1CCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CSCC(N1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CSCC(N1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1SCC(NC1=O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1SCC(NC1=O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__