AB62515
35276-83-6 | 2-Methoxybenzoylacetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB62515
ChemicalName
2-Methoxybenzoylacetonitrile
CasNumber
35276-83-6
MolecularFormula
C10H9NO2
MolecularWeight
175.184
MdlNumber
MFCD01993554
Smiles
N#CCC(=O)c1ccccc1OC
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AB62515
ChemicalName: 2-Methoxybenzoylacetonitrile
CasNumber: 35276-83-6
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD01993554
Smiles: N#CCC(=O)c1ccccc1OC
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AB62515
ChemicalName:
2-Methoxybenzoylacetonitrile
CasNumber:
35276-83-6
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD01993554
Smiles:
N#CCC(=O)c1ccccc1OC
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C=NCc1ccccc1OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C=NCc1ccccc1OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB62517
ChemicalName: Methyl 2-oxocyclohexanecarboxylate
CasNumber: 41302-34-5
MolecularFormula: C8H12O3
MolecularWeight: 156.1791
MdlNumber: MFCD00077699
Smiles: COC(=O)C1CCCCC1=O
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AB62517
ChemicalName:
Methyl 2-oxocyclohexanecarboxylate
CasNumber:
41302-34-5
MolecularFormula:
C8H12O3
MolecularWeight:
156.1791
MdlNumber:
MFCD00077699
Smiles:
COC(=O)C1CCCCC1=O
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.1
CatalogNumber: AB62518
ChemicalName: 2-Methoxycarbonylphenylboronic acid
CasNumber: 374538-03-1
MolecularFormula: C8H9BO4
MolecularWeight: 179.9657
MdlNumber: MFCD02179452
Smiles: COC(=O)c1ccccc1B(O)O
Complexity: 183
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB62518
ChemicalName:
2-Methoxycarbonylphenylboronic acid
CasNumber:
374538-03-1
MolecularFormula:
C8H9BO4
MolecularWeight:
179.9657
MdlNumber:
MFCD02179452
Smiles:
COC(=O)c1ccccc1B(O)O
Complexity:
183
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
__