92407-84-6 Purity
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Specification
The molecular formula of Asischem v95851 is C17H13Cl2NO.
The molecular weight of Asischem v95851 is 318.2 g/mol.
The IUPAC Name of Asischem v95851 is 1-[(3,4-dichlorophenyl)methyl]-2-methylindole-3-carbaldehyde.
The InChI of Asischem v95851 is InChI=1S/C17H13Cl2NO/c1-11-14(10-21)13-4-2-3-5-17(13)20(11)9-12-6-7-15(18)16(19)8-12/h2-8,10H,9H2,1H3.
The InChIKey of Asischem v95851 is RNGOKNYVPSWVRH-UHFFFAOYSA-N.
The canonical SMILES of Asischem v95851 is CC1=C(C2=CC=CC=C2N1CC3=CC(=C(C=C3)Cl)Cl)C=O.
The CAS number of Asischem v95851 is 92407-88-0.
The XLogP3-AA value of Asischem v95851 is 4.7.
Asischem v95851 has 0 hydrogen bond donors.
Asischem v95851 has 3 rotatable bonds.