AD49343
153687-35-5 | 1-(4-Methoxybenzyl)-1H-pyrazole-4-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AD49343
ChemicalName
1-(4-Methoxybenzyl)-1H-pyrazole-4-carbaldehyde
CasNumber
153687-35-5
MolecularFormula
C12H12N2O2
MolecularWeight
216.2359
MdlNumber
MFCD22201150
Smiles
COc1ccc(cc1)Cn1ncc(c1)C=O
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
1.3
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CatalogNumber: AD49343
ChemicalName: 1-(4-Methoxybenzyl)-1H-pyrazole-4-carbaldehyde
CasNumber: 153687-35-5
MolecularFormula: C12H12N2O2
MolecularWeight: 216.2359
MdlNumber: MFCD22201150
Smiles: COc1ccc(cc1)Cn1ncc(c1)C=O
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1.3
CatalogNumber:
AD49343
ChemicalName:
1-(4-Methoxybenzyl)-1H-pyrazole-4-carbaldehyde
CasNumber:
153687-35-5
MolecularFormula:
C12H12N2O2
MolecularWeight:
216.2359
MdlNumber:
MFCD22201150
Smiles:
COc1ccc(cc1)Cn1ncc(c1)C=O
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1.3
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Smiles: CCC([Mg+])C.[Cl-]
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Smiles:
CCC([Mg+])C.[Cl-]
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Smiles: [O-][N+](=O)c1c2[nH]c3c(c2cc(c1O)[N+](=O)[O-])cccc3
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Smiles:
[O-][N+](=O)c1c2[nH]c3c(c2cc(c1O)[N+](=O)[O-])cccc3
Complexity:
__
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__
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Smiles: COCNC(=O)OC
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__
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Smiles:
COCNC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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