AB73653
36821-26-8 | 2-Oxo-pyrrolidine-3-carboxylic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB73653
ChemicalName
2-Oxo-pyrrolidine-3-carboxylic acid ethyl ester
CasNumber
36821-26-8
MolecularFormula
C7H11NO3
MolecularWeight
157.1671
MdlNumber
MFCD06796534
Smiles
CCOC(=O)C1CCNC1=O
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.1
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CatalogNumber: AB73653
ChemicalName: 2-Oxo-pyrrolidine-3-carboxylic acid ethyl ester
CasNumber: 36821-26-8
MolecularFormula: C7H11NO3
MolecularWeight: 157.1671
MdlNumber: MFCD06796534
Smiles: CCOC(=O)C1CCNC1=O
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.1
CatalogNumber:
AB73653
ChemicalName:
2-Oxo-pyrrolidine-3-carboxylic acid ethyl ester
CasNumber:
36821-26-8
MolecularFormula:
C7H11NO3
MolecularWeight:
157.1671
MdlNumber:
MFCD06796534
Smiles:
CCOC(=O)C1CCNC1=O
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC(C(=O)OCC)C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC(C(=O)OCC)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB73655
ChemicalName: Ethyl 2-phenylacetoacetate
CasNumber: 5413-05-8
MolecularFormula: C12H14O3
MolecularWeight: 206.2378
MdlNumber: MFCD00040490
Smiles: CCOC(=O)C(c1ccccc1)C(=O)C
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 2
CatalogNumber:
AB73655
ChemicalName:
Ethyl 2-phenylacetoacetate
CasNumber:
5413-05-8
MolecularFormula:
C12H14O3
MolecularWeight:
206.2378
MdlNumber:
MFCD00040490
Smiles:
CCOC(=O)C(c1ccccc1)C(=O)C
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC(=C)C(=O)OCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC(=C)C(=O)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__