1.0 2016-05-19 04:05:15 UTC 2026-08-25 07:50:45 UTC Benzaldehyde, 3,4-dimethyl- SmallMolecule Benzaldehyde, 3,4-dimethyl- is an organic compound with the formula C9H10O and an average molecular weight of 134.18 g/mol. Benzaldehyde, 3,4-dimethyl- belongs to the benzoyl derivatives, a subclass of benzene and substituted derivatives within the organic compounds. This compound is found in or released from four recorded sources related to food, food processing, and cookware, specifically including fermentation processes for beer, the preparation of vinegar, and the preparation of wine or sparkling wine, as well as food contact materials. Recorded exposure routes for the substance include inhalation, oral, and touch. 3,4-Dimethylbenzaldehyde C9H10O 134.178 134.073164942 3,4-dimethylbenzaldehyde 3,4-dimethylbenzaldehyde 5973-71-7 CC1=CC=C(C=O)C=C1C InChI=1S/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3 POQJHLBMLVTHAU-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Benzoyl derivatives Benzoyl derivatives Benzaldehydes Hydrocarbon derivatives Organic oxides o-Xylenes Aldehyde Aromatic homomonocyclic compound Aryl-aldehyde Benzaldehyde Benzoyl Hydrocarbon derivative O-xylene Organic oxide Organic oxygen compound Organooxygen compound Xylene Aromatic homomonocyclic compounds Detected and Not Quantified logp 2.7 logp 2.41 ALOGPS logs -2.45 ALOGPS solubility 4.77e-01 g/l ALOGPS logp 2.71 ChemAxon pka_strongest_basic -7.1 ChemAxon iupac 3,4-dimethylbenzaldehyde ChemAxon average_mass 134.178 ChemAxon mono_mass 134.073164942 ChemAxon smiles CC1=CC=C(C=O)C=C1C ChemAxon formula C9H10O ChemAxon inchi InChI=1S/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3 ChemAxon inchikey POQJHLBMLVTHAU-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 42.72 ChemAxon polarizability 15.16 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7226789570> 22278 21170540