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CAS No.: | 150436-68-3 |
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Name: | (+/-)-2-(P-METHOXYPHENOXY)PROPIONIC ACID |
Molecular Structure: | |
Formula: | C10H12O4·Na |
Molecular Weight: | 238.24 |
Synonyms: | Lactisole;Envision;Propanoic acid, 2-(4-methoxyphenoxy)-, sodium salt (9CI); |
Appearance: | White to pale cream crystalline solid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 55.76000 |
LogP: | 1.54710 |
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The Sodium 2-(4-methoxyphenoxy)propionate, with the CAS registry number 150436-68-3, is also known as Lactisole. This chemical's molecular formula is C10H12O4·Na and molecular weight is 218.18. What's more, its systematic name is Sodium 2-(4-methoxyphenoxy)propanoate.
Physical properties of Sodium 2-(4-methoxyphenoxy)propionate are: (1)ACD/LogP: 1.654; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 55.76 Å2; (7)Flash Point: 130.3 °C; (8)Enthalpy of Vaporization: 60.62 kJ/mol; (9)Boiling Point: 331.6 °C at 760 mmHg; (10)Vapour Pressure: 6.15E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[O-]C(=O)C(Oc1ccc(OC)cc1)C
(2)Std. InChI: InChI=1S/C10H12O4.Na/c1-7(10(11)12)14-9-5-3-8(13-2)4-6-9;/h3-7H,1-2H3,(H,11,12);/q;+1/p-1
(3)Std. InChIKey: SKORRGYRKQDXRS-UHFFFAOYSA-M