10453-89-1

10453-89-1结构式

常用中文名：2,2-D2,2-二甲基-3-(2-甲基丙-1-烯-1-基)环丙烷甲酸
常用英文名：Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-
CAS号：10453-89-1
分子式：C₁₀H₁₆O₂
分子量：168.23300
相关类别：化学农药原药杀虫剂中间体
发布时间：2018-08-23 15:12:28
更新时间：2024-01-09 17:27:58
菊花酸(NSC 11779)是一种有机化合物,与多种天然和合成杀虫剂有关,用于预防虫媒疾病等[1]。

中文名	菊甲酸
英文名	chrysanthemic acid
中文别名	降虫菊酸 2,2-二甲基-3-(2-甲基-1-丙烯)环丙烷羧酸
英文别名	chrysanthemummonocarboxylicacidmixedisomers CHRYSANTHEMUM MONOCARBOXYLIC ACID chrysanthemumicacid Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)- CIS/TRANS-CHRYSANTHEMIC ACID 3-Isobutenyl-2,2-dimethylcyclopropanecarboxylic acid

描述	菊花酸(NSC 11779)是一种有机化合物,与多种天然和合成杀虫剂有关,用于预防虫媒疾病等[1]。
相关类别	研究领域 >> 其他信号通路 >> 其他 >> 其他
参考文献	[1]. Takanori Yamashiro, et al. Draft genome of Tanacetum cinerariifolium, the natural source of mosquito coil. Sci Rep. 2019 Dec 3;9(1):18249.

密度	1.077g/cm3
沸点	246.4ºC at 760 mmHg
熔点	50-51 °C
分子式	C₁₀H₁₆O₂
分子量	168.23300
闪点	119ºC
精确质量	168.11500
PSA	37.30000
LogP	2.30940
外观性状	固体
蒸汽压	0.0088mmHg at 25°C
折射率	1.546
储存条件	室温，密封，干燥
计算化学	1.疏水参数计算参考值（XlogP）:无 2.氢键供体数量:1 3.氢键受体数量:2 4.可旋转化学键数量:2 5.互变异构体数量:无 6.拓扑分子极性表面积:37.3 7.重原子数量:12 8.表面电荷:0 9.复杂度:234 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:2 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GZ1270000

CHEMICAL NAME :: Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-

CAS REGISTRY NUMBER :: 10453-89-1

BEILSTEIN REFERENCE NO. :: 2043418

LAST UPDATED :: 199701

DATA ITEMS CITED :: 12

MOLECULAR FORMULA :: C10-H16-O2

MOLECULAR WEIGHT :: 168.26

WISWESSER LINE NOTATION :: L3TJ A1 A1 BVQ C1UY1&1

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 :: 2500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LC - Lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >400 mg/m3

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1250 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LC - Lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >400 mg/m3

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >5 gm/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - excitement

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 150 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 2500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LC50 - Lethal concentration, 50 percent kill

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Mammal - species unspecified

DOSE/DURATION :: >586 mg/m3

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - excitement

MUTATION DATA

TEST SYSTEM :: Rodent - mouse

DOSE/DURATION :: 1248 mg/m3

REFERENCE :: GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 51(1),16,1986

危害码 (欧洲)	Xn
海关编码	2916209090

97-41-6

~90%

10453-89-1

文献：Pohjala, Leena; Alakurtti, Sami; Ahola, Tero; Yli-Kauhaluoma, Jari; Tammela, Paeivi Journal of Natural Products, 2009 , vol. 72, # 11 p. 1917 - 1926

4489-12-7

10453-89-1

文献：US4182906 A1, ;

7427-85-2

~46%

10453-89-1

文献：Armesto, Diego; Gallego, Mar G.; Horspool, William M.; Agarrabeitia, Antonia R. Tetrahedron, 1995 , vol. 51, # 33 p. 9223 - 9240

5617-92-5

~64%

10453-89-1

文献：Green, Graham; Griffith, William P.; Hollinshead, David M.; Ley, Steven V.; Schroeder, Martin Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984 , # 4 p. 681 - 686

110-03-2

10453-89-1

文献：Helvetica Chimica Acta, , vol. 7, p. 385

6223-78-5

10453-89-1

文献：Helvetica Chimica Acta, , vol. 7, p. 385

623-73-4

764-13-6

10453-89-1

文献：Helvetica Chimica Acta, , vol. 7, p. 385

6227-48-1

5460-63-9

10453-89-1

文献：Helvetica Chimica Acta, , vol. 7, p. 196,234, 452

6227-48-1

97-41-6

10453-89-1

文献：Helvetica Chimica Acta, , vol. 7, p. 255

上游产品 9
97-41-6 4489-12-7 7427-85-2 5617-92-5
110-03-2 6223-78-5 623-73-4 764-13-6
6227-48-1
下游产品 2
54406-48-3 271241-14-6

海关编码	2916209090
中文概述	2916209090 其他（环烷、环烯、环萜烯）一元羧酸（包括酸酐、酰卤化物，过氧化物和过氧酸及该税号的衍生物）. 增值税率:17.0% 退税率:9.0% 监管条件:AB(入境货物通关单,出境货物通关单) 最惠国关税:6.5% 普通关税:30.0%
申报要素	品名, 成分含量, 用途, 丙烯酸、丙烯酸盐或酯应报明包装
监管条件	A.入境货物通关单 B.出境货物通关单
检验检疫	R.进口食品卫生监督检验 S.出口食品卫生监督检验 M.进口商品检验 N.出口商品检验
Summary	2916209090 other cyclanic, cyclenic or cyclotherpenic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

56-41-7	108-65-6
56-35-9	64-17-5
67-56-1	108-88-3
141-78-6	1310-73-2
13463-67-7	1333-86-4