29106-32-9

29106-32-9结构式
29106-32-9结构式

化源商城直购

中文名 晁模酸
英文名 (S)-chaulmoogric acid
中文别名 BETA-萘喹啉硫酸盐
11-(2-環戊烯)十一酸
2-环戊烯十三烷酸
大風子酸
英文别名 Chaulmoogrinsaeure
hydnocarpylacetic acid
(-)-(S)-13-(cyclopent-2-en-1-yl)tridecanoic acid
2-Cyclopentene-1-tridecanoic acid
13-(Cyclopent-2-enyl)tridecanoic acid
chaulmoogric acid
13-cyclopent-2-en-1-yltridecanoic acid
2-Cyclopentene-1-tridecanoic acid,(S)
(S)-2-Cyclopentene-1-tridecanoic acid
密度 0.948g/cm3
沸点 408.2ºC at 760mmHg
熔点 68.5ºC
分子式 C18H32O2
分子量 280.44500
闪点 305ºC
精确质量 280.24000
PSA 37.30000
LogP 5.71840
蒸汽压 8.29E-08mmHg at 25°C
折射率 1.483
计算化学

1.疏水参数计算参考值(XlogP):7

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:13

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:20

8.表面电荷:0

9.复杂度:271

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:1

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 :
GY6340000
CHEMICAL NAME :
2-Cyclopentene-1-tridecanoic acid, (S)-
CAS REGISTRY NUMBER :
29106-32-9
BEILSTEIN REFERENCE NO. :
3204530
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H32-O2
MOLECULAR WEIGHT :
280.50

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,373,1954

海关编码 2916209090

~57%

29106-32-9结构式

29106-32-9

文献:Seemann, Matthias; Schoeller, Markus; Kudis, Steffen; Helmchen, Guenter European Journal of Organic Chemistry, 2003 , # 11 p. 2122 - 2127

~%

29106-32-9结构式

29106-32-9

文献:Seemann, Matthias; Schoeller, Markus; Kudis, Steffen; Helmchen, Guenter European Journal of Organic Chemistry, 2003 , # 11 p. 2122 - 2127

~%

29106-32-9结构式

29106-32-9

文献:Seemann, Matthias; Schoeller, Markus; Kudis, Steffen; Helmchen, Guenter European Journal of Organic Chemistry, 2003 , # 11 p. 2122 - 2127

~%

29106-32-9结构式

29106-32-9

文献:Seemann, Matthias; Schoeller, Markus; Kudis, Steffen; Helmchen, Guenter European Journal of Organic Chemistry, 2003 , # 11 p. 2122 - 2127
上游产品  4

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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%