75625-99-9

• 常用中文名：Α-甲基-4-(2-甲基-1-丙烯-1-基)苯乙酸
• 常用英文名：2-[4-(2-Methyl-propenyl)phenyl]propionic Acid
• CAS号：75625-99-9
• 分子式：C₁₃H₁₆O₂
• 分子量：204.26500
• 发布时间：2016-10-09 06:08:07
• 更新时间：2026-07-07 13:42:38

名称

• 中文名: Α-甲基-4-(2-甲基-1-丙烯-1-基)苯乙酸
• 英文名: 2-[4-(2-Methyl-propenyl)phenyl]propionic Acid
• 中文别名: 布洛芬相关化合物1; 布洛芬杂质73; 2 - [4 - (2 - 甲基丙烯基)苯基]丙酸
• 英文别名: Benzeneacetic acid, α-methyl-4-(2-methyl-1-propen-1-yl); GX-258; Ibuprofen Impurity 73; Ibuprofen Impurity 72; 2-{[4-(2-Methyl-1-propenyl)phenyl]}propionic Acid; 2-<p-(2-methylprop-1-ene)phenyl>propionic acid; acido 2-(4-dimetilvinilfenil)propionico; 2-<(4-(2-methyl-1-propenyl)phenyl)>propionic acid; α-Methyl-4-(2-methyl-1-propenyl)benzeneacetic acid; Ibuprofen Related Compound 1; α-Methyl-4-(2-methyl-1-propen-1-yl)benzeneacetic acid; 2-(4'-<2"-methyl-1"-propenyl>phenyl)propanoic acid; IBUPROFEN VINYL IMPURITY; 2-(4-dimethylvinylphenyl)propionic acid; Ibuprofen Related Compound 1 (2-(4-(2-Methylpropenyl)phenyl)propionic Acid)

物化性质

• 分子式: C₁₃H₁₆O₂
• 分子量: 204.26500
• 精确质量: 204.11500
• PSA: 37.30000
• LogP: 3.29790

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : MU6642000 CHEMICAL NAME : Hydratropic acid, p-(2-methylpropenyl)- CAS REGISTRY NUMBER : 75625-99-9 LAST UPDATED : 199612 DATA ITEMS CITED : 2 MOLECULAR FORMULA : C13-H16-O2 MOLECULAR WEIGHT : 204.29 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1295 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 39,421,1984 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1634 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 39,421,1984

合成路线

77601-60-6 ~89% 75625-99-9

文献：Amano; Yoshikawa; Ogawa; Sano; Ohuchi; Tanami; Ota; Hatayama; Higuchi; Amanuma Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 11 p. 4653 - 4662

859828-48-1 ~% 75625-99-9

文献：Moriconi, Alessio; Cesta, Maria Candida; Cervellera, Maria Neve; Aramini, Andrea; Coniglio, Silvia; Colagioia, Sandro; Beccari, Andrea Rosario; Bizzarri, Cinzia; Cavicchia, Michela Rita; Locati, Massimo; Galliera, Emanuela; Di Benedetto, Paola; Vigilante, Paolo; Bertini, Riccardo; Allegretti, Marcello Journal of Medicinal Chemistry, 2007 , vol. 50, # 17 p. 3984 - 4002

75625-98-8 ~% 75625-99-9

文献：Kurtz, Richard R.; Houser, David J. Journal of Organic Chemistry, 1981 , vol. 46, # 1 p. 202 - 203

15687-27-1 ~% 75625-99-9

文献：Kurtz, Richard R.; Houser, David J. Journal of Organic Chemistry, 1981 , vol. 46, # 1 p. 202 - 203

10400-18-7 ~% 75625-99-9

文献：Amano; Yoshikawa; Ogawa; Sano; Ohuchi; Tanami; Ota; Hatayama; Higuchi; Amanuma Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 11 p. 4653 - 4662

19366-15-5 ~% 75625-99-9

文献：Amano; Yoshikawa; Ogawa; Sano; Ohuchi; Tanami; Ota; Hatayama; Higuchi; Amanuma Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 11 p. 4653 - 4662

51833-36-4 ~% 75625-99-9

文献：Amano; Yoshikawa; Ogawa; Sano; Ohuchi; Tanami; Ota; Hatayama; Higuchi; Amanuma Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 11 p. 4653 - 4662

3017-69-4 34645-72-2 ~% 75625-99-9

文献：Hamon, David P. G.; Massy-Westropp, Ralph A.; Newton, Josephine L. Tetrahedron Letters, 1993 , vol. 34, # 33 p. 5333 - 5336

上下游产品

上游产品  7
75625-98-8 15687-27-1 10400-18-7 19366-15-5
51833-36-4 3017-69-4 34645-72-2
下游产品  3
75626-01-6 75626-00-5 51146-55-5