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Name |
3,5-Dimethoxyphenylpropionic acid |
EINECS | N/A |
CAS No. | 717-94-2 | Density | 1.159 g/cm3 |
PSA | 55.76000 | LogP | 1.72100 |
Solubility | N/A | Melting Point |
60-62°C |
Formula | C11H14O4 | Boiling Point | 363.8 °C at 760 mmHg |
Molecular Weight | 210.23 | Flash Point | 141.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Hydrocinnamicacid, 3,5-dimethoxy- (6CI,7CI,8CI);3,5-Dimethoxybenzenepropanoic acid;3,5-Dimethoxyhydrocinnamic acid;3,5-Dimethoxyphenylpropionic acid;3-(3,5-Dimethoxyphenyl)propanoic acid; |
Article Data | 19 |
The Benzenepropanoic acid,3,5-dimethoxy-, with the CAS registry number 717-94-2, is also known as 3,5-Dimethoxyphenylpropionic acid. It belongs to the product categories of Aromatic Propionic Acids; Organic acids. This chemical's molecular formula is C11H14O4 and molecular weight is 210.22646. Its IUPAC name is called 3-(3,5-dimethoxyphenyl)propanoic acid.
Physical properties of Benzenepropanoic acid,3,5-dimethoxy-: (1)ACD/LogP: 1.55; (2)ACD/LogD (pH 5.5): 0.64; (3)ACD/BCF (pH 5.5): 1.08; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 20.3; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.522; (11)Molar Refractivity: 55.35 cm3; (12)Molar Volume: 181.3 cm3; (13)Surface Tension: 40.9 dyne/cm; (14)Density: 1.159 g/cm3; (15)Flash Point: 141.1 °C; (16)Enthalpy of Vaporization: 64.35 kJ/mol; (17)Boiling Point: 363.8 °C at 760 mmHg; (18)Vapour Pressure: 6.25E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC(=CC(=C1)CCC(=O)O)OC
(2)InChI: InChI=1S/C11H14O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h5-7H,3-4H2,1-2H3,(H,12,13)
(3)InChIKey: LMBOJOXVLORKSQ-UHFFFAOYSA-N