AB39299
303111-41-3 | (S)-1-Benzyl-3-n-boc-aminomethylpyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AB39299
ChemicalName
(S)-1-Benzyl-3-n-boc-aminomethylpyrrolidine
CasNumber
303111-41-3
MolecularFormula
C17H26N2O2
MolecularWeight
290.4005
MdlNumber
MFCD09991604
Smiles
O=C(OC(C)(C)C)NC[C@@H]1CCN(C1)Cc1ccccc1
Complexity
332
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
2.8
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CatalogNumber: AB39299
ChemicalName: (S)-1-Benzyl-3-n-boc-aminomethylpyrrolidine
CasNumber: 303111-41-3
MolecularFormula: C17H26N2O2
MolecularWeight: 290.4005
MdlNumber: MFCD09991604
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CCN(C1)Cc1ccccc1
Complexity: 332
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2.8
CatalogNumber:
AB39299
ChemicalName:
(S)-1-Benzyl-3-n-boc-aminomethylpyrrolidine
CasNumber:
303111-41-3
MolecularFormula:
C17H26N2O2
MolecularWeight:
290.4005
MdlNumber:
MFCD09991604
Smiles:
O=C(OC(C)(C)C)NC[C@@H]1CCN(C1)Cc1ccccc1
Complexity:
332
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1C(=O)N)Br
Complexity: 174
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
__
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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:
COc1ccc(cc1C(=O)N)Br
Complexity:
174
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2
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ChemicalName: __
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MolecularFormula: __
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Smiles: CNCCCOc1ccc(cc1)OC
Complexity: __
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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:
CNCCCOc1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC(CCOP(=O)(O)OP(=O)(O)O)(CBr)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(CCOP(=O)(O)OP(=O)(O)O)(CBr)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__