3,5-Dimethoxyphenylpropionic acid supplier

Name
3,5-DIMETHOXYPHENYLPROPIONIC ACID
EINECS
CAS No. 717-94-2
Article Data19
CAS DataBase
Density 1.159 g/cm³
Solubility
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
Appearance
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;
PSA 55.76000
LogP 1.72100

3,5-Dimethoxyphenylpropionic acid Specification

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

Product Name

3,5-DIMETHOXYPHENYLPROPIONIC ACID

3,5-Dimethoxyphenylpropionic acid Specification

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