IUPAC Name: 3-(4-ethylphenyl)-2,2-dimethylpropanal
Empirical Formula: C13H18O
Molecular Weight: 190.2814g/mol
EINECS: 266-819-2
Index of Refraction: 1.5
Molar Refractivity: 59.4 cm3
Molar Volume: 201.9 cm3
Polarizability: 23.54×10-24cm3
Surface Tension: 32.9 dyne/cm
Density: 0.942 g/cm3
Flash Point: 118 °C
Enthalpy of Vaporization: 50.56 kJ/mol
Boiling Point: 267.6 °C at 760 mmHg
Vapour Pressure: 0.00808 mmHg at 25°C
Canonical SMILES: CCC1=CC=C(C=C1)CC(C)(C)C=O
InChI: InChI=1S/C13H18O/c1-4-11-5-7-12(8-6-11)9-13(2,3)10-14/h5-8,10H,4,9H2,1-3H3
InChIKey: JFTSYAALCNQOKO-UHFFFAOYSA-N
Structure of Ethyl dimethylhydrocinnamaldehyde (CAS NO.67634-15-5):
1. | orl-rat LDLo:5 g/kg | FCTOD7 Food and Chemical Toxicology. 26 (1988),307. | ||
2. | skn-rbt LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 26 (1988),307. |
Reported in EPA TSCA Inventory.
Low toxicity by ingestion and skin contact. A combustible liquid. When heated to decomposition it emits acrid smoke and irritating vapors.
Ethyl dimethylhydrocinnamaldehyde , its cas register number is 67634-15-5. It also can be called 2,2-Dimethyl-3-(p-ethylphenyl)propanal ; Benzenepropanal, 2(or 4)-ethyl-alpha,alpha-dimethyl- ; Benzenepropanal, 4-ethyl-alpha,alpha-dimethyl- ; EINECS 266-819-2 ; Floralozone ; alpha,alpha-Dimethyl-4-ethylbenzenepropanal ; alpha,alpha-Dimethyl-p-ethylphenylpropanal . Ethyl dimethylhydrocinnamaldehyde (CAS NO.67634-15-5) is a combustible liquid. And it is low toxic by ingestion and skin contact. .
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