142-46-1 (双硫脲,2,5-Dithiobiurea)

结构式:
CAS号:
142-46-1
中文名称:
双硫脲
英文名称:
2,5-Dithiobiurea
安全信息:
分子式:
C2H6N4S2
分子量:
150.225836277008
简介:
双硫脲,英文名称为2,5-Dithiobiurea,别名为二硫代脲,CAS号为142-46-1,分子式为C2H6N4S2,带有刺激性,用作医药中间体。

双硫脲(142-46-1)名称与标识符

名称

中文别名:
双硫脲;二硫代脲;2,5-二硫二脲;2,5-二硫代联二脲;2,5-二硫代脲;碘化锆(IV);肼-1,2-双(硫代酰胺);双硫脲,AR;碳酸钴;1,2-二(氨基硫代甲酰)肼;双硫脲 ​;5-二硫代联二脲;2,5-二硫代二脲;2,5-二硫代联脲;二硫代脲,97%;2,5-二硫脲,97%;
英文别名:
Hydrazine-1,2-bis(carbothioamide);1,2-Hydrazine-o-dicarbothioamide;1,2-Hydrazine carbothioamide;1,2-Hydrazinedicarbothioamide;2,5-dithiourea;Dithiocarbamoyl hydrazine;bisthiocarbamyl hydrazine;bis(thiourea);2,5-Dithiobiurea;Hydrazodicarbothioamide;Sucrose benzoate;1-thiocarbamoylthiosemicarbazide;bisthiourea;bithiourea;DITHIODIUREA;DITHIOUREA;hydrazodithiocarbamide;N,N'-bis-(amidothiocarbonyl)-hydrazine;usafb-44;usafb-55;usafek-p-6281;nci-c03009;DITHIOBIUREA;2,5-Dithiodiurea;Dithiocarbamoylhydrazine;Bithiourea (VAN);(carbamothioylamino)thiourea;Biurea, 2,5-dithio-;Dithiobiurea (VAN);N,N'-Bis(thiocarbamyl)hydrazine;2,5-Dithiodiurea (VAN);Hydrazine, N,N'-di(thiocarbamyl)-;Hydrazine, N,N'-bis(thiocarbamyl)-;CCRIS;HSDB 2746;NSC-3511;NSC 3511;CAS-142-46-1;Dithiocarbamoylhydrazine (VAN);USAF B-55;825972ISQX;KCOYHFNCTWXETP-UHFFFAOYSA-N;J-007657;CCRIS 273;N,N'-Bis[thiocarbamyl]hydrazine;NCGC00331503-01;Tox21_303027;AKOS001056191;WLN: SUYZMMYZUS;Biurea, 2,5-dithio- (VAN);CHEMBL541231;NCGC00259904-01;AI3-19872;1,2-DITHIOCARBAMOYLHYDRAZINE;NSC3511;DTXSID8020545;AB01326209-02;EINECS 205-537-6;BRN 1723178;N,N'-Bisthiocarbamyl hydrazine;DTXCID80545;Tox21_202355;USAF ek-p-6281;AMY8980;C2H6N4S2;D83826;NS00024630;NCGC00091408-03;4-03-00-00386 (Beilstein Handbook Reference);SCHEMBL438395;Q27269309;Z56853893;D1308;AS-16163;WLN: SUYZM 2;1,2-BIS(THIOCARBAMOYL)HYDRAZINE;(N H2 C S N H)2;142-46-1;NCGC00091408-01;USAF B-44;CS-W016323;UNII-825972ISQX;SB85910;NCGC00091408-02;A807910;EN300-16988;Hydrazine,N'-di(thiocarbamyl)-;MFCD00014471;Hydrazine,N'-bis[thiocarbamyl]-;hydrazine-1,2-dicarbothioamide;NCGC00256544-01;FT-0610495;2,5-DITHIOBIUREA [HSDB];STK801324;BBL009888;1,2-Hydrazinedicarbothioamide; 2,5-Dithiobiurea;DB-042629;2,5Dithiodiurea (VAN);1,2Hydrazinedicarbothioamide;Hydrazine, N,N'bis(thiocarbamyl);N,N'Bisthiocarbamyl hydrazine;Biurea, 2,5dithio;Hydrazine, N,N'di(thiocarbamyl);Biurea, 2,5-dithio-(VAN);205-537-6;N,N'Bis(thiocarbamyl)hydrazine;Biurea, 2,5-dithio-(VAN) (8CI);2,5Dithiodiurea;

标识符

MDL:
MFCD00014471
InChIKey:
KCOYHFNCTWXETP-UHFFFAOYSA-N
Inchi:
1S/C2H6N4S2/c3-1(7)5-6-2(4)8/h(H3,3,5,7)(H3,4,6,8)
SMILES:
S=C(N)NNC(N)=S
BRN:
1723178

双硫脲(142-46-1)物化性质

实验特性

  • LogP : 0.75020
  • PSA : 140.28000
  • 折射率 : 1.5605 (estimate)
  • 水溶性 : Soluble in hot water, pyridine, triethylamine and dimethylformamide. Insoluble in cold water.
  • 沸点 : Decomposes
  • 熔点 : 212 ºC (dec.)
  • 闪点 : 130.1°C
  • 颜色与性状 : 白色至类白色结晶粉末
  • 溶解性 : 几乎不溶于水,溶于热水。
  • 密度 : 1.412 (estimate)

计算特性

  • 精确分子量 : 150.00300
  • 氢键供体数量 : 4
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 0
  • 同位素质量 : 150.003
  • 重原子数量 : 8
  • 复杂度 : 96.6
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : -0.9
  • 互变异构体数量 : 6
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 140

双硫脲(142-46-1)国际标准相关数据

EINECS:
3511

双硫脲(142-46-1)海关数据

海关编码:
2930909090
海关数据:

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

Summary:

2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

双硫脲(142-46-1)相关文献

双硫脲(142-46-1)参考资料

Reaxys RN:
1723178
Beilstein:
205-537-6
PubChem CID:

双硫脲(142-46-1) MSDS

基础信息

Name:2 5-Dithiobiurea 99% Material Safety Data Sheet
Synonym:Bisthiocarbamyl Hydrazine; N,N'-Bisthiocarbamyl Hydrazine
CAS:142-46-1
Section 1 - Chemical Product ? MSDS Name:2 5-Dithiobiurea 99% Material Safety Data Sheet
Synonym:Bisthiocarbamyl Hydrazine; N,N'-Bisthiocarbamyl Hydrazine

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
142-46-12,5-Dithiobiurea99205-537-6
Hazard Symbols: T
Risk Phrases: 23/24/25 43 45

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Toxic by inhalation, in contact with skin and if swallowed. May cause sensitization by skin contact. May cause cancer.The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May cause skin sensitization, an allergic reaction, which becomes evident upon re-exposure to this material.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
Repeated or prolonged exposure may cause allergic reactions in sensitive individuals.

Section 4 - FIRST AID MEASURES
? Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
? General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 142-46-1: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Powder
Color: white
Odor: none reported
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 200.00 - 203.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: negligible
Specific Gravity/Density:
Molecular Formula: C2H6N4S2
Molecular Weight: 150.22

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, hydrogen sulfide, sulfur oxides (SOx), including sulfur oxide and sulfur dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 142-46-1: EC1460000 LD50/LC50:
Not available.
Carcinogenicity:
2,5-Dithiobiurea - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
?

Section 13 - DISPOSAL CONSIDERATIONS
? Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
?
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T
Risk Phrases:
R 45 May cause cancer.
R 23/24/25 Toxic by inhalation, in contact with skin
and if swallowed.
R 43 May cause sensitization by skin contact.
Safety Phrases:
S 53 Avoid exposure - obtain special instructions
before use.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 142-46-1: No information available.
Canada
CAS# 142-46-1 is listed on Canada's NDSL List.
CAS# 142-46-1 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 142-46-1 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A