(2-methyl-4,6-dinitrophenyl) acetate

(2-methyl-4,6-dinitrophenyl) acetate 基本信息
CAS号 18461-55-7 分子式 C9H8N2O6
分子量 240.17000 精确质量  240.03800
PSA  117.94000 LogP  2.78310

基本信息 展开↓

CAS号:
18461-55-7
3D弹球模型:
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分子式:
C9H8N2O6
分子量:
240.17000
英文名称:
(2-methyl-4,6-dinitrophenyl) acetate
英文别名:
(2-methyl-4,6-dinitrophenyl) acetate;
Acetic acid,4,6-dinitro-o-cresyl ester;
Phenol,2-methyl-4,6-dinitro,acetate;
3.5-Dinitro-2-acetoxy-toluol;
2-methyl-4,6-dinitrophenyl acetate;
3.5-Dinitro-2-acetoxy-1-methyl-benzol;
o-CRESOL,4,6-DINITRO-,ACETATE
精确分子量/精确质量:
240.03800
极性分子表面积/PSA:
117.94000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: OEMKFZGDLXBFNO-UHFFFAOYSA-N

物化性质展开↓

密度:
1.437g/cm3
沸点:
382.9ºC at 760 mmHg
闪点:
182ºC
折射率:
1.579
蒸汽压:
4.57E-06mmHg at 25°C

安全信息展开↓

海关代码:
2915390090

合成路线查看所有的合成路线

  • 534-52-1

    二硝酚

  • +

  • 108-24-7

    乙酸酐

  • ~70%

  • 18461-55-7

    (2-methyl-4,6-dinitrophenyl) acetate

  • 95-48-7

    2-甲酚

  • 18461-55-7

    (2-methyl-4,6-dinitrophenyl) acetate

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GP0175000
CHEMICAL NAME :
o-Cresol, 4,6-dinitro-, acetate
CAS REGISTRY NUMBER :
18461-55-7
BEILSTEIN REFERENCE NO. :
1994636
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H8-N2-O6
MOLECULAR WEIGHT :
240.19
WISWESSER LINE NOTATION :
WNR C1 ENW BOV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,749,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,749,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
62500 ug/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: 6,146,1954

海关数据查看详细

中国海关编码:2915390090

概述:
2915390090. 其他乙酸酯. 增值税率:17.0%. 退税率:13.0%. 监管条件:AB(入境货物通关单,出境货物通关单). 最惠国关税:5.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
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
摘要/Summary:
2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

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