Benzenepropanoic acid,2,4-dimethoxy- supplier

Name
3-(2 4-DIMETHOXYPHENYL)PROPIONIC ACID
EINECS
CAS No. 22174-29-4
Article Data3
CAS DataBase
Density 1.159 g/cm³
Solubility
Melting Point 100-104 °C(lit.)
Formula C₁₁H₁₄O₄
Boiling Point 351.9 °C at 760 mmHg
Molecular Weight 210.23
Flash Point 135.6 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hydrocinnamicacid, 2,4-dimethoxy- (7CI,8CI);
PSA 55.76000
LogP 1.72100

Benzenepropanoic acid,2,4-dimethoxy- Specification

The Benzenepropanoic acid,2,4-dimethoxy-, with the CAS registry number of 22174-29-4, is also known as Hydrocinnamicacid, 2,4-dimethoxy- (7CI,8CI). It belongs to the product categories of C11 to C12; Carbonyl Compounds; Carboxylic Acids. This chemical's molecular formula is C₁₁H₁₄O₄ and molecular weight is 210.23. What's more, its IUPAC name is 3-(2,4-Dimethoxyphenyl)propanoic acid.

Physical properties about the Benzenepropanoic acid,2,4-dimethoxy- are: (1)ACD/LogP: 1.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.76; (4)ACD/BCF (pH 5.5): 1.45; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 27.19; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 44.76Å²; (12)Index of Refraction: 1.522; (13)Molar Refractivity: 55.35 cm³; (14)Molar Volume: 181.3 cm³; (15)Surface Tension: 40.9 dyne/cm; (16)Density: 1.159 g/cm³; (17)Flash Point: 135.6 °C; (18)Enthalpy of Vaporization: 62.96 kJ/mol; (19)Boiling Point: 351.9 °C at 760 mmHg; (20)Vapour Pressure: 1.48E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
The dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)CCc1ccc(OC)cc1OC
(2) InChI: InChI=1/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)10(7-9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13)
(3) InChIKey: NVDCWSFMCUWKAL-UHFFFAOYAO

Product Name

3-(2 4-DIMETHOXYPHENYL)PROPIONIC ACID

Benzenepropanoic acid,2,4-dimethoxy- Specification

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