特罗芬那酯
- 中文名称：
- 特罗芬那酯
- 中文别名：
- 特罗芬那酯;
氯灭酸酯 氯芬那酸酯 特罗氨酯
- 英文名称：
- terofenamate
- 英文别名：
- ethoxymethyl 2-(2,6-dichloro-3-methylanilino)benzoate;
Terofenamato [INN-Spanish];
Etofen;
Etoclofene;
EINECS 249-434-4;
Terofenamate;
N-(2,6-Dichloro-m-tolyl)anthranilic acid ethoxymethyl ester;
M-(2,6-Dichloro-m-tolyl)anthranilic acid ethoxymethyl ester;
Ethoxymethyl N-(2,6-dichloro-m-tolyl)anthranilate;
Terofenamatum [INN-Latin]
- CAS No.：
- 29098-15-5
- 分 子 式：
-
C17H17Cl2NO3
- 分 子 量：
- 0
- 精确分子量：
- 353.05900
- PSA：
- 47.56000
- EINECS：
- 249-434-4
- InChI：
- The Key: FRQSLQPWXFAJFO-UHFFFAOYSA-N3
- SDS：
- 查看
特罗芬那酯 物化性质
- 密度：
- 1.297g/cm3
- 沸点：
- 439ºC at 760 mmHg
- 闪点：
- 219.3ºC
- 折射率：
- 1.597
- 蒸汽压：
- 6.6E-08mmHg at 25°C
特罗芬那酯 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CB2975100
- CHEMICAL NAME :
- Anthranilic acid, N-(2,6-dichloro-m-tolyl)-,
ethoxymethyl ester
- CAS REGISTRY NUMBER :
- 29098-15-5
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C17-H17-Cl2-N-O3
- MOLECULAR WEIGHT :
- 354.25
- WISWESSER LINE NOTATION :
- GR CG D1 BMR BVO1O2
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 :
- 307 mg/kg
- TOXIC EFFECTS :
- Lungs, Thorax, or Respiration - cough
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica,
Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year:
115,41,1976
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 274 mg/kg
- TOXIC EFFECTS :
- Lungs, Thorax, or Respiration - cough
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica,
Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year:
115,41,1976
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 918 mg/kg
- TOXIC EFFECTS :
- Gastrointestinal - other changes
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica,
Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year:
115,41,1976
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 300 mg/kg
- TOXIC EFFECTS :
- Gastrointestinal - other changes
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica,
Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year:
115,41,1976
** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 6240 mg/kg/26W-I
- TOXIC EFFECTS :
- Blood - changes in serum composition (e.g. TP, bilirubin, cholesterol)
Blood - changes in leukocyte (WBC) count
Related to Chronic Data - death
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica,
Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year:
115,41,1976
特罗芬那酯 海关数据
中国海关编码：2922509090
- 概述：
- 2922509090. 其他氨基醇酚、氨基酸酚及其他含氧基氨基化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件：AB. 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, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
- 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
- 摘要/Summary：
- 2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
特罗芬那酯 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值（XlogP）:5.8
2.氢键供体数量:1
3.氢键受体数量:4
4.可旋转化学键数量:7
5.互变异构体数量:4
6.拓扑分子极性表面积:47.6
7.重原子数量:23
8.表面电荷:0
9.复杂度:383
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:0
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