硫氰酸(对二甲氨基)苯酯

硫氰酸(对二甲氨基)苯酯 基本信息
CAS号 7152-80-9 分子式 C9H10N2S
分子量 178.25400 精确质量 　178.05600
PSA 　52.33000 LogP 　2.32578
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目录
基本信息 物化性质 安全信息 合成路线 毒性 海关数据 上下游

基本信息 展开↓

CAS号：
7152-80-9
3D弹球模型：
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分子式：
C9H10N2S
分子量：
178.25400
中文名称：
硫氰酸(对二甲氨基)苯酯
英文名称：
[4-(dimethylamino)phenyl] thiocyanate
中文别名：
硫氰酸(对二甲氨基)苯酯;
硫氨酸(对二-甲氨基)苯酯;
4-二甲基氨基硫氰酸苯酯
英文别名：
[4-(dimethylamino)phenyl] thiocyanate;
Me2NC6H4SCN;
Caswell No. 359E;
p-(Dimethylamino)thiocyanobenzene;
Defoliant 2929 RP;
4-(Dimethylamino)phenyl thiocyanate;
p-SCN-C6H4NMe2;
N,N-dimethyl-4-thiocyanatobenzenamine;
p-Thiocyanodimethylaniline;
N,N-dimethyl-4-thiocyanatobenzeneamine;
4-N,N-dimethylaminophenyl thiocyanate;
4-Thiocyano-N,N-dimethylaniline;
p-(Dimethylamino)phenylthiocyanate;
Dimethylaminorhodanbenzol;
Thiocyanic acid,4-(dimethylamino)phenyl ester;
4-thiocyanato-N,N-dimethylaniline
精确分子量/精确质量：
178.05600
极性分子表面积/PSA：
52.33000
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: WCCIEZDFRJREQJ-UHFFFAOYSA-N

物化性质展开↓

密度：
1.16 g/cm3
熔点：
71-73ºC
沸点：
303.6ºC at760mmHg
闪点：
137.4ºC
折射率：
1.599

安全信息展开↓

海关代码：
2930909090

合成路线查看所有的合成路线

  • 1147550-11-5

    1147550-11-5

  • +

  • 121-69-7

    N,N-二甲基苯胺

  • →

    ~97%

  • 7152-80-9

    硫氰酸(对二甲氨基)苯酯

  • 540-72-7

    硫氰酸钠

  • +

  • 121-69-7

    N,N-二甲基苯胺

  • →

    ~86%

  • 7152-80-9

    硫氰酸(对二甲氨基)苯酯

  • 333-20-0

    硫氰酸钾

  • +

  • 121-69-7

    N,N-二甲基苯胺

  • →

    ~10%

  • 7152-80-9

    硫氰酸(对二甲氨基)苯酯

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BX8050000
CHEMICAL NAME :
Aniline, N,N-dimethyl-p-thiocyanato-
CAS REGISTRY NUMBER :
7152-80-9
BEILSTEIN REFERENCE NO. :
2089838
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C9-H10-N2-S
MOLECULAR WEIGHT :
178.27
WISWESSER LINE NOTATION :
NCSR DN1&1

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 :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
150 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
28ZEAL "Pesticide Index," Frear, E.H., ed., State College, PA, College Science Pub., 1969 Volume(issue)/page/year: 4,181,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
55 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
JJPAAZ Japanese Journal of Pharmacology. (Japanese Pharmacological Soc., c/o Dept. of Pharmacology, Faculty of Medicine, Kyoto Univ., Sakyo-ku, Kyoto 606, Japan) V.1- 1951- Volume(issue)/page/year: 3,99,1954
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
150 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Lungs, Thorax, or Respiration - respiratory stimulation Lungs, Thorax, or Respiration - other changes
REFERENCE :
JJPAAZ Japanese Journal of Pharmacology. (Japanese Pharmacological Soc., c/o Dept. of Pharmacology, Faculty of Medicine, Kyoto Univ., Sakyo-ku, Kyoto 606, Japan) V.1- 1951- Volume(issue)/page/year: 3,99,1954
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02758
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1260 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974

海关数据查看详细

中国海关编码：2930909090

概述：
2930909090. 其他有机硫化合物. 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
摘要/Summary：
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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