AI43414
1932780-66-9 | (3S,4S)-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI43414
ChemicalName
(3S,4S)-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate
CasNumber
1932780-66-9
MolecularFormula
C10H20N2O2
MolecularWeight
200.278
MdlNumber
MFCD22689581
Smiles
N[C@@H]1CN(C[C@@H]1C)C(=O)OC(C)(C)C
Complexity
223
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.8
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CatalogNumber: AI43414
ChemicalName: (3S,4S)-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate
CasNumber: 1932780-66-9
MolecularFormula: C10H20N2O2
MolecularWeight: 200.278
MdlNumber: MFCD22689581
Smiles: N[C@@H]1CN(C[C@@H]1C)C(=O)OC(C)(C)C
Complexity: 223
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AI43414
ChemicalName:
(3S,4S)-tert-Butyl 3-amino-4-methylpyrrolidine-1-carboxylate
CasNumber:
1932780-66-9
MolecularFormula:
C10H20N2O2
MolecularWeight:
200.278
MdlNumber:
MFCD22689581
Smiles:
N[C@@H]1CN(C[C@@H]1C)C(=O)OC(C)(C)C
Complexity:
223
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1C[C@@H]([C@](C1)(O)C(F)(F)F)C)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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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(N1C[C@@H]([C@](C1)(O)C(F)(F)F)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(ccc1OC)N1C(=S)SCC1=O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(ccc1OC)N1C(=S)SCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc2c(c1)cn[nH]2
Complexity: 126
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc2c(c1)cn[nH]2
Complexity:
126
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5