AA30351
1253791-53-5 | Boc-(+/-)-trans-4-methyl-pyrrolidine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA30351
ChemicalName
Boc-(+/-)-trans-4-methyl-pyrrolidine-3-carboxylic acid
CasNumber
1253791-53-5
MolecularFormula
C11H19NO4
MolecularWeight
229.2729
MdlNumber
MFCD02179038
Smiles
CC1CN(CC1C(=O)O)C(=O)OC(C)(C)C
Complexity
295
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AA30351
ChemicalName: Boc-(+/-)-trans-4-methyl-pyrrolidine-3-carboxylic acid
CasNumber: 1253791-53-5
MolecularFormula: C11H19NO4
MolecularWeight: 229.2729
MdlNumber: MFCD02179038
Smiles: CC1CN(CC1C(=O)O)C(=O)OC(C)(C)C
Complexity: 295
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AA30351
ChemicalName:
Boc-(+/-)-trans-4-methyl-pyrrolidine-3-carboxylic acid
CasNumber:
1253791-53-5
MolecularFormula:
C11H19NO4
MolecularWeight:
229.2729
MdlNumber:
MFCD02179038
Smiles:
CC1CN(CC1C(=O)O)C(=O)OC(C)(C)C
Complexity:
295
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCOC(=O)c1cnn(c1N)c1ccccc1Cl.Cl
Complexity: 303
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCOC(=O)c1cnn(c1N)c1ccccc1Cl.Cl
Complexity:
303
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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Smiles: CC(C[C@H]1NCCN(C1)C(=O)OCc1ccccc1)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
CC(C[C@H]1NCCN(C1)C(=O)OCc1ccccc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCOC(=O)c1c(O)c2ccc(nc2n(c1=O)CC#C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1c(O)c2ccc(nc2n(c1=O)CC#C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__