AE45581
1427203-52-8 | (R)-tert-Butyl 3-(2-methoxy-2-oxoethoxy)pyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE45581
ChemicalName
(R)-tert-Butyl 3-(2-methoxy-2-oxoethoxy)pyrrolidine-1-carboxylate
CasNumber
1427203-52-8
MolecularFormula
C12H21NO5
MolecularWeight
259.2988
MdlNumber
MFCD24368660
Smiles
COC(=O)CO[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity
310
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
6
Xlogp3
1.1
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CatalogNumber: AE45581
ChemicalName: (R)-tert-Butyl 3-(2-methoxy-2-oxoethoxy)pyrrolidine-1-carboxylate
CasNumber: 1427203-52-8
MolecularFormula: C12H21NO5
MolecularWeight: 259.2988
MdlNumber: MFCD24368660
Smiles: COC(=O)CO[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity: 310
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 1.1
CatalogNumber:
AE45581
ChemicalName:
(R)-tert-Butyl 3-(2-methoxy-2-oxoethoxy)pyrrolidine-1-carboxylate
CasNumber:
1427203-52-8
MolecularFormula:
C12H21NO5
MolecularWeight:
259.2988
MdlNumber:
MFCD24368660
Smiles:
COC(=O)CO[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity:
310
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC[C@@](C1)(C)C(=O)O)OCc1ccccc1
Complexity: 351
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C(N1CC[C@@](C1)(C)C(=O)O)OCc1ccccc1
Complexity:
351
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H](CN1CCN(CC1)C(=O)OC(C)(C)C)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
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MolecularFormula:
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Smiles:
C[C@H](CN1CCN(CC1)C(=O)OC(C)(C)C)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H]1NCC(C1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1NCC(C1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__