AB73655
5413-05-8 | Ethyl 2-phenylacetoacetate
Manufacturer: A2B Chem
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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
NscNumber
6389
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
2
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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
NscNumber: 6389
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
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
NscNumber:
6389
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC(=C)C(=O)OCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC(=C)C(=O)OCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB73657
ChemicalName: Ethyl 2-pyrimidinecarboxylate
CasNumber: 42839-08-7
MolecularFormula: C7H8N2O2
MolecularWeight: 152.15062
MdlNumber: MFCD12197317
Smiles: CCOC(=O)c1ncccn1
NscNumber: __
Complexity: 132
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: -0.3
CatalogNumber:
AB73657
ChemicalName:
Ethyl 2-pyrimidinecarboxylate
CasNumber:
42839-08-7
MolecularFormula:
C7H8N2O2
MolecularWeight:
152.15062
MdlNumber:
MFCD12197317
Smiles:
CCOC(=O)c1ncccn1
NscNumber:
__
Complexity:
132
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc2c(n1)cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc2c(n1)cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__