二甲苯麝香,81-15-2，生产厂家，价格-洛克化工网移动版

二甲苯麝香

中文名称：: 二甲苯麝香

中文别名：: 二甲苯麝香;
1-三級丁-3,5-二甲-2,4,6-三硝苯;
1-(1,1-二甲基乙基)-3,5-二甲基-2,4,6-三硝基苯;
2,4,6-三硝基-1,3-二甲基-5-叔丁基苯;
5-叔丁基-2,4,6-三硝基间二甲苯;
2,4,6-三硝基-3,3-二甲基-5-叔丁基苯;
麝香茬

英文名称：: Musk Xylol

英文别名：: musk xylene;
xylenemusk;
1-t-butyl-3,5-dimethyl-2,4,6-trinitrobenzene;
MOSCHUS XYLOL;
Musk xylene solution;
1-tert-butyl-3,5-dimethyl-2,4,6-trinitrobenzene;
2,4,6-trinitro-5-tert-butyl-1,3-dimethylbenzene;
5-tert-butyl-1,3-dimethyl-2,4,6-trinitrobenzene;
musk xylol;
MUSK XLYENE;
Musk xyldl;
MUSK XYLENE

CAS No.：: 81-15-2

分子式：: C₁₂H₁₅N₃O₆

分子量：: 297.27

精确分子量：: 297.09600

PSA：: 137.46000

EINECS：: 201-329-4

InChI：: InChI=1/C12H15N3O6/c1-6-9(13(16)17)7(2)11(15(20)21)8(12(3,4)5)10(6)14(18)19/h1-5H33

风险术语：: 2-40-50/53-36-20/21/22-11

分子结构式：

SDS：: 查看

二甲苯麝香制备方法及用途

制备方法

氯代叔丁烷在氯化铝存在下，与间二甲苯作用生成1,3-二甲苯-5-叔丁基苯，再用浓硝酸硝化而制得。

合成制备方法

氯代叔丁烷在氯化铝存在下，与间二甲苯作用生成1,3-二甲苯-5-叔丁基苯，再用浓硝酸硝化而制得。

用途简介

用于化妆品，香皂及其它洗涤用品香精和熏香香精及好的定香剂。

用途

用作化妆品香精和皂用香精的定香剂。可用于食品。

二甲苯麝香物化性质

外观与性状：: 淡黄色针状粉末
密度：: 1.325 g/cm3
熔点：: 235.4°C
沸点：: 392.3ºCat 760 mmHg
闪点：: 2 °C
折射率：: 1.573
其它信息：: 1.性状：淡黄色结晶。
2.溶点（ºC）：112.5～114.5
3.沸点（ºC）：200～202
4.闪点（ºC）：81
5.溶解性：不溶于水，微溶于乙醇、丙二醇、甘油，溶于大多数香料。遇光色泽变深。

二甲苯麝香安全信息

危险类别码：: R2
安全说明：: S36/37-S46-S60-S61-S16
安全标志：: S46:万一发生不慎吞咽，立刻寻求医生的建议（展示产品容器或者标签）。
S60:本物质残余物和容器必须作为危险废物处理。
S61:避免排放到环境中。参考专门的说明/安全数据表。
S16:远离火源。
:
危险标志：: E,Xn,N,F

二甲苯麝香毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CZ7210000

CHEMICAL NAME :: Benzene, 1-(1,1-dimethylethyl)-3,5-dimethyl-2,4,6-trinitro-

CAS REGISTRY NUMBER :: 81-15-2

BEILSTEIN REFERENCE NO. :: 2015910

LAST UPDATED :: 199701

DATA ITEMS CITED :: 13

MOLECULAR FORMULA :: C12-H15-N3-O6

MOLECULAR WEIGHT :: 297.30

WISWESSER LINE NOTATION :: WNR B1 F1 CNW ENW DX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Human

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,881,1975 ** ACUTE TOXICITY DATA **

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >10 gm/kg

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

REFERENCE :: BECTA6 Bulletin of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1966- Volume(issue)/page/year: 26,656,1981

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >4 gm/kg

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

REFERENCE :: FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 28,581,1990

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

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: >15 gm/kg

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

REFERENCE :: BECTA6 Bulletin of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1966- Volume(issue)/page/year: 26,656,1981 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 5040 mg/kg/14D-C

TOXIC EFFECTS :: Behavioral - tremor Gastrointestinal - ulceration or bleeding from stomach Related to Chronic Data - death

REFERENCE :: ESKHA5 Eisei Shikenjo Hokoku. Bulletin of the Institute of Hygienic Sciences. (Kokuritsu Eisei Shikenjo Kagaku, 18-1 Bushitsu Johobu, Setagaya-ku, Tokyo 158, Japan) V.1- 1886- Volume(issue)/page/year: (108),89,1990

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 21420 mg/kg/17W-C

TOXIC EFFECTS :: Related to Chronic Data - death

REFERENCE :: ESKHA5 Eisei Shikenjo Hokoku. Bulletin of the Institute of Hygienic Sciences. (Kokuritsu Eisei Shikenjo Kagaku, 18-1 Bushitsu Johobu, Setagaya-ku, Tokyo 158, Japan) V.1- 1886- Volume(issue)/page/year: (108),89,1990 ** TUMORIGENIC DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 36 gm/kg/80W-C

TOXIC EFFECTS :: Tumorigenic - Carcinogenic by RTECS criteria Liver - tumors Endocrine - tumors

REFERENCE :: FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 28,581,1990 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 65,477,1996 IARC Cancer Review:Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 65,477,1996 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 65,477,1996 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83002 No. of Facilities: 463 (estimated) No. of Industries: 7 No. of Occupations: 29 No. of Employees: 89788 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83002 No. of Facilities: 9459 (estimated) No. of Industries: 81 No. of Occupations: 86 No. of Employees: 134413 (estimated) No. of Female Employees: 48955 (estimated)

二甲苯麝香分子结构与计算化学数据

分子结构数据

1、摩尔折射率：69.72

2、摩尔体积（cm³/mol）：207.5

3、等张比容（90.2K）：564.0

4、表面张力（dyne/cm）：54.5

5、极化率（10-24cm3）：27.64

计算化学数据

1.疏水参数计算参考值（XlogP）:3.8

2.氢键供体数量:0

3.氢键受体数量:6

4.可旋转化学键数量:1

5.互变异构体数量:无

6.拓扑分子极性表面积138

7.重原子数量:21

8.表面电荷:0

9.复杂度:416

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

二甲苯麝香上游产品

1-叔丁基-3,5-二甲苯 4-叔丁基-2,6-二甲基乙酰苯间二甲苯 4-叔丁基-2,6-二甲基硝基苯

二甲苯麝香下游产品

嘧啶,4-(1-甲基乙基)-2-苯基- (9CI) 2-[[5-氨基甲酰-1,6-二氢-2-羟基-4-甲基-6-羰基-1-[2-(4-磺基苯基)乙基]-3-吡啶基]偶氮]-5-[(3-磷羧基苯基)偶氮]苯磺基酸 (8S,9S)-4-(羟甲基)-8,9-二氢四芬-8,9-二醇

二甲苯麝香

二甲苯麝香制备方法及用途

制备方法

合成制备方法

用途简介

用途

二甲苯麝香物化性质

二甲苯麝香安全信息

二甲苯麝香毒理性

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

二甲苯麝香分子结构与计算化学数据

分子结构数据

计算化学数据

二甲苯麝香上游产品

二甲苯麝香下游产品

二甲苯麝香表征图谱

推荐供应商

武汉吉鑫益邦生物科技有限公司

二甲苯麝香

二甲苯麝香

二甲苯麝香 制备方法及用途

制备方法

合成制备方法

用途简介

用途

二甲苯麝香 物化性质

二甲苯麝香 安全信息

二甲苯麝香 毒理性

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

二甲苯麝香 分子结构与计算化学数据

分子结构数据

计算化学数据

二甲苯麝香 上游产品

二甲苯麝香 下游产品

二甲苯麝香 表征图谱

推荐供应商

武汉吉鑫益邦生物科技有限公司

二甲苯麝香

二甲苯麝香制备方法及用途

二甲苯麝香物化性质

二甲苯麝香安全信息

二甲苯麝香毒理性

二甲苯麝香分子结构与计算化学数据

二甲苯麝香上游产品

二甲苯麝香下游产品

二甲苯麝香表征图谱