AI38752
169750-01-0 | (S)-3-(N-Boc-N-methylamino)pyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AI38752
ChemicalName
(S)-3-(N-Boc-N-methylamino)pyrrolidine
CasNumber
169750-01-0
MolecularFormula
C10H20N2O2
MolecularWeight
200.278
MdlNumber
MFCD08703388
Smiles
O=C(N([C@@H]1CNCC1)C)OC(C)(C)C
Complexity
211
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.9
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CatalogNumber: AI38752
ChemicalName: (S)-3-(N-Boc-N-methylamino)pyrrolidine
CasNumber: 169750-01-0
MolecularFormula: C10H20N2O2
MolecularWeight: 200.278
MdlNumber: MFCD08703388
Smiles: O=C(N([C@@H]1CNCC1)C)OC(C)(C)C
Complexity: 211
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AI38752
ChemicalName:
(S)-3-(N-Boc-N-methylamino)pyrrolidine
CasNumber:
169750-01-0
MolecularFormula:
C10H20N2O2
MolecularWeight:
200.278
MdlNumber:
MFCD08703388
Smiles:
O=C(N([C@@H]1CNCC1)C)OC(C)(C)C
Complexity:
211
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(S(=O)(=O)[O-])CC1CCCCC1.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(S(=O)(=O)[O-])CC1CCCCC1.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI38754
ChemicalName: 2-Bromo-5-(pentyloxy)pyridine
CasNumber: 1697878-14-0
MolecularFormula: C10H14BrNO
MolecularWeight: 244.1283
MdlNumber: MFCD28143958
Smiles: CCCCCOc1ccc(nc1)Br
Complexity: 132
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 5
Xlogp3: 3.6
CatalogNumber:
AI38754
ChemicalName:
2-Bromo-5-(pentyloxy)pyridine
CasNumber:
1697878-14-0
MolecularFormula:
C10H14BrNO
MolecularWeight:
244.1283
MdlNumber:
MFCD28143958
Smiles:
CCCCCOc1ccc(nc1)Br
Complexity:
132
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
5
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCNC(=N)NN.I
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCNC(=N)NN.I
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__