CAS No.120-13-8,4-Ethoxy-3-methoxyphenylacetic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	120-13-8
Name:	4-Ethoxy-3-methoxyphenylacetic acid
Article Data:	5

Formula:	C₁₁H₁₄O₄
Molecular Weight:	210.23
Synonyms:	4-Ethoxy-3-methoxyphenylacetic acid;Aceticacid, (4-ethoxy-3-methoxyphenyl)- (6CI,7CI,8CI);(4-Ethoxy-3-methoxyphenyl)acetic acid;2-(4-Ethoxy-3-methoxyphenyl)acetic acid;4-Ethoxy-3-methoxybenzeneacetic acid;NSC 62696;
EINECS:	204-372-7
Density:	1.159 g/cm³
Melting Point:	122-124 °C
Boiling Point:	344.144 °C at 760 mmHg
Flash Point:	132.005 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	55.76000
LogP:	1.72100

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Specification

This chemical is called 4-Ethoxy-3-methoxyphenylacetic acid, and it can also be named as benzeneacetic acid, 4-ethoxy-3-methoxy-. With the molecular formula of C₁₁H₁₄O₄, its molecular weight is 210.23. The CAS registry number of this chemical is 120-13-8, and its product categories are Aromatic Phenylacetic Acids and Derivatives.

Other characteristics of the 4-Ethoxy-3-methoxyphenylacetic acid can be summarised as followings: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.59; (4)ACD/LogD (pH 7.4): -1.2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.54; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 44.76 Å²; (13)Index of Refraction: 1.522; (14)Molar Refractivity: 55.35 cm³; (15)Molar Volume: 181.3 cm³; (16)Polarizability: 21.94×10^-24cm³; (17)Surface Tension: 40.9 dyne/cm; (18)Density: 1.159 g/cm³; (19)Flash Point: 132 °C; (20)Enthalpy of Vaporization: 62.06 kJ/mol; (21)Boiling Point: 344.1 °C at 760 mmHg; (22)Vapour Pressure: 2.56E-05 mmHg at 25°C.

Uses of this chemical: The 4-Ethoxy-3-methoxyphenylacetic acid could react with formaldehyde, and obtain the 7-ethoxy-6-methoxyisochroman-3-one. This reaction needs the reagent of conc. HCl, and the solvent of acetic acid. The yield is 82 %.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin, so you should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)Cc1cc(OC)c(OCC)cc1
2. InChI: InChI=1/C11H14O4/c1-3-15-9-5-4-8(7-11(12)13)6-10(9)14-2/h4-6H,3,7H2,1-2H3,(H,12,13)
3.InChIKey: XVNXRPVJRCYHEW-UHFFFAOYAN