AB46081
4911-54-0 | Ethyl 4-methyl-4-pentenoate
Manufacturer: A2B Chem
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CatalogNumber
AB46081
ChemicalName
Ethyl 4-methyl-4-pentenoate
CasNumber
4911-54-0
MolecularFormula
C8H14O2
MolecularWeight
142.1956
MdlNumber
MFCD00075160
Smiles
CCOC(=O)CCC(=C)C
Complexity
127
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
RotatableBondCount
5
Xlogp3
2.1
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CatalogNumber: AB46081
ChemicalName: Ethyl 4-methyl-4-pentenoate
CasNumber: 4911-54-0
MolecularFormula: C8H14O2
MolecularWeight: 142.1956
MdlNumber: MFCD00075160
Smiles: CCOC(=O)CCC(=C)C
Complexity: 127
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 2.1
CatalogNumber:
AB46081
ChemicalName:
Ethyl 4-methyl-4-pentenoate
CasNumber:
4911-54-0
MolecularFormula:
C8H14O2
MolecularWeight:
142.1956
MdlNumber:
MFCD00075160
Smiles:
CCOC(=O)CCC(=C)C
Complexity:
127
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccc(cc1)C
Complexity: 146
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccc(cc1)C
Complexity:
146
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AB46083
ChemicalName: Ethyl 4-methylvalerate
CasNumber: 25415-67-2
MolecularFormula: C8H16O2
MolecularWeight: 144.2114
MdlNumber: MFCD00042887
Smiles: CCOC(=O)CCC(C)C
Complexity: 97.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 2.1
CatalogNumber:
AB46083
ChemicalName:
Ethyl 4-methylvalerate
CasNumber:
25415-67-2
MolecularFormula:
C8H16O2
MolecularWeight:
144.2114
MdlNumber:
MFCD00042887
Smiles:
CCOC(=O)CCC(C)C
Complexity:
97.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
2.1
CatalogNumber: AB46084
ChemicalName: Ethyl 4-nitrobenzoylacetate
CasNumber: 838-57-3
MolecularFormula: C11H11NO5
MolecularWeight: 237.2087
MdlNumber: MFCD00007357
Smiles: CCOC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB46084
ChemicalName:
Ethyl 4-nitrobenzoylacetate
CasNumber:
838-57-3
MolecularFormula:
C11H11NO5
MolecularWeight:
237.2087
MdlNumber:
MFCD00007357
Smiles:
CCOC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__