AA64359
146256-99-7 | 1-tert-Butyl 3-ethyl 4-hydroxypyrrolidine-1,3-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA64359
ChemicalName
1-tert-Butyl 3-ethyl 4-hydroxypyrrolidine-1,3-dicarboxylate
CasNumber
146256-99-7
MolecularFormula
C12H21NO5
MolecularWeight
259.2988
MdlNumber
MFCD24466305
Smiles
CCOC(=O)C1CN(CC1O)C(=O)OC(C)(C)C
Complexity
323
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
2
Xlogp3
1
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CatalogNumber: AA64359
ChemicalName: 1-tert-Butyl 3-ethyl 4-hydroxypyrrolidine-1,3-dicarboxylate
CasNumber: 146256-99-7
MolecularFormula: C12H21NO5
MolecularWeight: 259.2988
MdlNumber: MFCD24466305
Smiles: CCOC(=O)C1CN(CC1O)C(=O)OC(C)(C)C
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 2
Xlogp3: 1
CatalogNumber:
AA64359
ChemicalName:
1-tert-Butyl 3-ethyl 4-hydroxypyrrolidine-1,3-dicarboxylate
CasNumber:
146256-99-7
MolecularFormula:
C12H21NO5
MolecularWeight:
259.2988
MdlNumber:
MFCD24466305
Smiles:
CCOC(=O)C1CN(CC1O)C(=O)OC(C)(C)C
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
2
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C1CN(CC1=O)C(=O)OC(C)(C)C
Complexity: 358
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C1CN(CC1=O)C(=O)OC(C)(C)C
Complexity:
358
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(OC)c2c(c1)n(cc2)C(=O)c1ccc(cc1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(OC)c2c(c1)n(cc2)C(=O)c1ccc(cc1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C=C(NNC(=O)c1ccncc1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C=C(NNC(=O)c1ccncc1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__