5-phenyl-3H-1,3,4-thiadiazole-2-thione

5-phenyl-3H-1,3,4-thiadiazole-2-thione 基本信息
CAS号 5585-19-3 分子式 C8H6N2S2
分子量 194.27700 精确质量  193.99700
PSA  92.82000 LogP  2.49380

基本信息 展开↓

CAS号:
5585-19-3
3D弹球模型:
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分子式:
C8H6N2S2
分子量:
194.27700
英文名称:
5-phenyl-3H-1,3,4-thiadiazole-2-thione
英文别名:
5-phenyl-3H-1,3,4-thiadiazole-2-thione;
2-Phenyl-1,3,4-thiadiazoline-5-thione;
5-phenyl-1,3,4-thiadiazole-2(3H)-thione;
5-Phenyl-1,3,4-thiadiazole-2-thiol;
1,3,4-Thiadiazole-2-thiol,5-phenyl;
5-Phenyl-2-mercapto-1,3,4-thiadiazole;
2-Mercapto-5-fenil-1,3,4-tiadiazolo [Italian];
5-phenyl-3H-[1,3,4]thiadiazole-2-thione;
5-Phenyl-1,3,4-thiadiazol-2-thione;
L 1542;
2-phenyl-1,3,4-thiadiazole-5(4H)-thione
精确分子量/精确质量:
193.99700
极性分子表面积/PSA:
92.82000
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: ZTLMHGOWADYAHM-UHFFFAOYSA-N

物化性质展开↓

密度:
1.41g/cm3
沸点:
298.8ºC at 760 mmHg
闪点:
134.5ºC
折射率:
1.746

安全信息展开↓

海关代码:
2934999090

合成路线查看所有的合成路线

  • 10465-97-1

    ethyl N-benzamidocarbamate

  • ~77%

  • 24028-40-8

    5-苯基-1,3,4-噻二唑-2(3H)-酮

  • +

  • 5585-19-3

    5-phenyl-3H-1,3,4-thiadiazole-2-thione

  • 134786-00-8

    2-phenyl-4-ethoxycarbonyl-1,3,4-thiadiazole-5(4H)-thione

  • ~8%

  • 5585-19-3

    5-phenyl-3H-1,3,4-thiadiazole-2-thione

  • +

  • 113642-47-0

    2-ethylsulfanyl-5-phenyl-1,3,4-thiadiazole

  • 7647-01-0

    氯化氢

  • +

  • 117891-38-0

    1-thiobenzoyl-thiosemicarbazide

  • 5585-19-3

    5-phenyl-3H-1,3,4-thiadiazole-2-thione

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XI4800000
CHEMICAL NAME :
1,3,4-Thiadiazole-2-thiol, 5-phenyl-
CAS REGISTRY NUMBER :
5585-19-3
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H6-N2-S2
MOLECULAR WEIGHT :
194.28
WISWESSER LINE NOTATION :
T5NN DSJ CR& ESH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
276 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - cyanosis Lungs, Thorax, or Respiration - other changes
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 13,187,1958

海关数据查看详细

中国海关编码:2934999090

概述:
2934999090. 其他杂环化合物. 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:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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上游产品

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  • 10465-97-1

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  • 75-15-0

    二硫化碳

  • 613-94-5

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下游产品

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  • 98556-95-7

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    2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetic acid

  • 63886-81-7

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