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1928-44-5

1928-44-5结构式
1928-44-5结构式

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中文名 2,4-滴辛酯
英文名 2,4-D-octyl
中文别名 2,4-二氯苯氧乙酸正辛酯
英文别名 Octyl ester of 2,4-D
EINECS 217-674-9
2,4-Dichlorphenoxyessigsaeure-n-octylester
octyl 2-(2,4-dichlorophenoxy)acetate
octyl (2,4-dichlorophenoxy)acetate
Octyl 2,4-dichlorophenoxyacetate
2,4-Dichlorphenoxyacetic acid octyl ester
2,4-D Octyl ester
密度 1.151g/cm3
沸点 401.7ºC at 760mmHg
分子式 C16H22Cl2O3
分子量 333.25000
闪点 139.6ºC
精确质量 332.09500
PSA 35.53000
LogP 5.27590
蒸汽压 1.16E-06mmHg at 25°C
折射率 1.507
计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:0

3.氢键受体数量:3

4.可旋转化学键数量:11

5.互变异构体数量:无

6.拓扑分子极性表面积:35.5

7.重原子数量:21

8.表面电荷:0

9.复杂度:287

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AG8850000
CHEMICAL NAME :
Acetic acid, 2,4-dichlorophenoxy-, octyl ester
CAS REGISTRY NUMBER :
1928-44-5
BEILSTEIN REFERENCE NO. :
2336407
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C16-H22-Cl2-O3
MOLECULAR WEIGHT :
333.28
WISWESSER LINE NOTATION :
GR CG DO1VO8

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,95,1982
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,95,1982 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 1 mg/m3 JAN 1993

危险类别 3.2
海关编码 2918990090
海关编码 2918990090
中文概述 2918990090. 其他含其他附加含氧基羧酸(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:13.0%. 监管条件:无. 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
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%