CAS No.4513-73-9,4-METHOXY-3-METHYLPHENYLACETIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	4513-73-9
Name:	4-METHOXY-3-METHYLPHENYLACETIC ACID
Article Data:	3

Formula:	C₁₀H₁₂O₃
Molecular Weight:	180.203
Synonyms:	Aceticacid, (4-methoxy-m-tolyl)- (7CI,8CI);2-(4-Methoxy-3-methylphenyl)acetic acid;3-Methyl-4-methoxyphenylacetic acid;4-Methoxy-3-methylbenzeneacetic acid;4-Methoxy-3-methylphenylacetic acid;
Density:	1.146 g/cm³
Melting Point:	93 °C
Boiling Point:	313.4 °C at 760 mmHg
Flash Point:	123.4 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	46.53000
LogP:	1.63070

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Specification

This chemical is called 4-Methoxy-3-methylphenylacetic acid, and it can also be named as Benzeneacetic acid, 4-methoxy-3-methyl-. With the molecular formula of C₁₀H₁₂O₃, its molecular weight is 180.20. The CAS registry number of this chemical is 4513-73-9. Additionally, its product category is Phenylacetic Acid.

Other characteristics of the 4-Methoxy-3-methylphenylacetic acid can be summarised as followings: (1)ACD/LogP: 1.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.8; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1.3; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20.68; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 48.87 cm³; (15)Molar Volume: 157.1 cm³; (16)Polarizability: 19.37×10^-24cm³; (17)Surface Tension: 41.9 dyne/cm; (18)Density: 1.146 g/cm³; (19)Flash Point: 123.4 °C; (20)Enthalpy of Vaporization: 58.54 kJ/mol; (21)Boiling Point: 313.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000212 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if 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)Cc1ccc(OC)c(c1)C
2.InChI: InChI=1/C10H12O3/c1-7-5-8(6-10(11)12)3-4-9(7)13-2/h3-5H,6H2,1-2H3,(H,11,12)
3.InChIKey: GYBWDAKGSPTODN-UHFFFAOYAP