53498-62-7

53498-62-7 structure
53498-62-7 structure
  • Name: PROPANOIC ACID, 2-METHYL-2-(2-METHYLPHENOXY)-
  • Chemical Name: 2-methyl-2-(2-methylphenoxy)propanoic acid
  • CAS Number: 53498-62-7
  • Molecular Formula: C11H14O3
  • Molecular Weight: 194.22700
  • Create Date: 2018-12-25 13:44:39
  • Modify Date: 2025-08-26 19:00:53

Name 2-methyl-2-(2-methylphenoxy)propanoic acid
Density 1.116g/cm3
Boiling Point 302.8ºC at 760mmHg
Molecular Formula C11H14O3
Molecular Weight 194.22700
Flash Point 114ºC
Exact Mass 194.09400
PSA 46.53000
LogP 2.23700
Index of Refraction 1.523

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UF6134100
CHEMICAL NAME :
Propionic acid, 2-methyl-2-(o-tolyloxy)-
CAS REGISTRY NUMBER :
53498-62-7
BEILSTEIN REFERENCE NO. :
2098501
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-O3
MOLECULAR WEIGHT :
194.25

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
467 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TSPMA6 Travaux de la Societe de Pharmacie de Montpellier. (Soc. de Pharmacie de Montpellier, Faculte de Pharmacie de Montpellier, Ave. Ch.-Flahault, 34060 Montpellier, France) V.1- 1942- Volume(issue)/page/year: 34,121,1974
HS Code 2918990090

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Literature: Shamovsky, Igor; De Graaf, Chris; Alderin, Lisa; Bengtsson, Malena; Bladh, Hakan; Boerjesson, Lena; Connolly, Stephen; Dyke, Hazel J.; Van Den Heuvel, Marco; Johansson, Henrik; Josefsson, Bo-Goeran; Kristoffersson, Anna; Linnanen, Tero; Lisius, Annea; Maennikkoe, Roope; Norden, Bo; Price, Steve; Ripa, Lena; Rognan, Didier; Rosendahl, Alexander; Skrinjar, Marco; Urbahns, Klaus Journal of Medicinal Chemistry, 2009 , vol. 52, # 23 p. 7706 - 7723

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Literature: WO2005/49578 A1, ; Page/Page column 160 ; WO 2005/049578 A1

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Literature: Organic Process Research and Development, , vol. 11, # 6 p. 1032 - 1042

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Literature: Organic Process Research and Development, , vol. 11, # 6 p. 1032 - 1042

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Literature: Medicinal Chemistry, , vol. 8, # 2 p. 293 - 298

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Literature: Atti della Accademia Nazionale dei Lincei, Classe di Scienze Fisiche, Matematiche e Naturali, Rendiconti, , vol. <5> 15 I, p. 586 Gazzetta Chimica Italiana, , vol. 36 II, p. 337

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Literature: Chemische Berichte, , vol. 33, p. 1254

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Literature: Chemische Berichte, , vol. 33, p. 1254
HS Code 2918990090
Summary 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
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