Hexachloro-1,3-Butadiene 六氯-1,3-丁二烯

CAS 87-68-3 MFCD00000836

化学结构图

87-68-3
SMILES: ClC(Cl)=C(Cl)C(Cl)=C(Cl)Cl

化学属性

Mol. FormulaCCl2=CClCCl=CCl2
Mol. Weight261
Refractive indexn20/D 1.555(lit.)
Boiling Point210-220
Density1.665
Melting Point-22 - -19
TSCAYes
Vapor Pressure0.2 mmHg ( 20 °C)
Flash Point210-220°C
Solubility不溶于水,溶于醇、醚。

别名和识别编码

Chemical NameHexachloro-1,3-Butadiene
CAS Number87-68-3
Synonym perchlorobutadiene C 46 Hexachlorobutadiene 1,1,2,3,4,4-Hexachloro-1,3-butadiene {uni_hamburg} Gp-40-66:120 1 hexachlorobutadiene HCB 六氯丁二稀标准溶液;全氯丁二烯;六氯-1,3-丁二烯;1,1,2,3,4,4-六氯-1,3-丁二烯 Dolen-pur 1,3-butadiene, 1,1,2,3,4,4-hexachloro- 1,3-Hexachlo butadiene, hexachloro- hexachlorobuta-1,3-diene HEXACHLOR-1,3 BUTADIENE 六氯丁二烯 RCRA waste number U128 hexachloro-1,3-butadiene 1,1,2,3,4,4-hexachloro-3-butadiene PERCHLORBUTADIENE Butadiene, hexachloro- HCBD 1,1,2,3,4,4-Hexachloro-buta-1,3-diene 2 六氯-1 六氯-1,3-丁二烯 六氯代-1,3-丁二烯 Hexachlor-1,3,butadien
PubChem Substance ID6901
EC Number201-765-5
Beilstein Registry Number1766570
MDL NumberMFCD00000836
Merck Number14,4678
Chemical Name Translation六氯-1,3-丁二烯
Wiswesser Line NotationGYGUYGYGUYGG
LabNetwork Molecule IDLN01995766
InChIInChI=1S/C4Cl6/c5-1(3(7)8)2(6)4(9)10
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分类

  • Alpha sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Fungicides, H,
  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards,

产品应用

  • 用作溶剂、热载体、热交换剂、水力系统用液体、洗液,也用于合成橡胶工业

相关文献及参考

  • Birner, G., et al.: Toxicol. Appl. Pharmacol., 132, 203 (1995),
  • Kirby, G., et al.: Toxicol. Pathol., 23, 303 (1995),
  • Merck: 14,4678
  • Merck: 14,4678 Beilstein: 1,IV,988
  • Short: II/25C
  • Short: II/3
  • Wolf, C., et al.: J. Pharmacol. Exp. Ther., 228, 202 (1984),

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H310 Fatal in contact with skin 皮肤接触致命
  • H351 Suspected of causing cancer 怀疑致癌
  • H301 Toxic if swallowed 吞食有毒
  • H318 Causes serious eye damage 严重伤害眼睛
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes T T,N,F T,N
RTECSEJ0700000
Precautionary statements
  • P301+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P302+P350
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P305+P351+P338
Signal word
UN Number UN2279 UN 2279 6.1/PG 3
Risk Statements
Safety Statements
Packing GroupIII
Hazard Class6.1
Storage condition 本系有机溶液标准物质需在低温(<10℃)及避光条件下存放 储存温度2-8℃ +4°C
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 15 gm/kg/2Y-C
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Kidney, Ureter, Bladder - Kidney tumors
REFERENCE :
   AIHAAP American Industrial Hygiene Association Journal.  (AIHA, 475 Wolf
   Ledges Pkwy., Akron, OH 44311)  V.19-    1958-  Volume(issue)/page/year:
   38,589,1977

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 76 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJTXAZ European Journal of Toxicology and Environmental Hygiene.  (Paris,
   France)  V.7-9, 1974-76. For publisher information, see TOERD9.
   Volume(issue)/page/year: 7,247,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   30ZDA9 "Chemistry of Pesticides," Melnikov, N.N., New York, Springer-Verlag
   New York, Inc., 1971  Volume(issue)/page/year: -,40,1971

TYPE OF TEST            : LD50 - Le

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 37(2),32,1972

TYPE OF TEST

{hazard_

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 370 mg/m3
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 37(2),32,1972

{haz

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 1400 ug/L
REFERENCE :
   EMMUEG Environmental and Molecular Mutagenesis.  (Alan R. Liss, Inc., 41 E.
   11th St., New York, NY 10003)  V.10-    1987-  Volume(issue)/page/year:
   10(Suppl 10),1,1987

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 320 ug/plate
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 7,431,1986

TYPE OF TEST            : Unscheduled DNA synthesis
ROUTE OF EXPOSURE       : Oral
TEST SYSTEM             : Rodent - rat
DOSE/DURATION           : 77 g

TYPE OF TEST            : Cytogenetic analysis
ROUTE OF EXPOSURE       : Oral
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 2 mg/kg
REFERENCE :
   CYGEDX Cytology and Genetics (English Translation).  Translation of TGANAK.
   (Allerton Press Inc., 150 Fifth Ave., New York, NY 10011)  V.8-    1974-
   Volume(issue)/page/year: 22(4),46,1988

TYPE OF TEST            : Morphological transformation
TEST SYSTEM             : Rodent - hamster Embryo
DOSE/DURATION           : 10 mg/L
REFERENCE :
   CALEDQ Cancer Letters (Shannon, Ireland).  (Elsevier Scientific Pub. Ireland
   Ltd., POB 85, Limerick, Ireland)  V.1-    1975- Volume(issue)/page/year:
   23,297,1984

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 1 mg/plate
REFERENCE :
   DHEFDK HEW Publication (FDA. United States).  (Washington, DC)  ?-1979(?).
   For publisher information, see HPFSDS.  Volume(issue)/page/year:
   FDA-78-1046,1978

TYPE OF TEST            : Cytogen

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 178 mg/kg
SEX/DURATION            : female 1-22 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - Central Nervous System
   Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight
   gain)
REFERENCE :
   AAGEAA Arkhiv Anatomii, Gistologii i Embriologii.  Archives of Anatomy,
   Histology and Embryology. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR)
   V.1-101, 1916-91.  Discontinued  Volume(issue)/page/year:

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 150 mg/kg
SEX/DURATION            : female 1-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
REFERENCE :
   SWEHDO Scandinavian Journal of Work, Environment and Health. (Haartmaninkatu
   1, SF-00290 Helsinki, 29, Finland)  V.1-    1975- Volume(issue)/page/year:
   7(Suppl 4),66,1981

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 10920 ug/kg
SEX/DURATION            : male 13 week(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: PB91-185884

TYPE OF TEST            : TDLo - Lowe

其他信息

  • 用途二:作溶剂、热载体、热交换剂、水力系统用液体、洗液,也用于合成橡胶工业。 校准仪器和装置;评价方法;工作标准;质量保证/质量控制;其他。
  • MOL 文件:87-68-3.mol
  • 储运特性:库房通风低温干燥; 与食品添加剂分开存放
  • 职业标准:TWA 0.21 毫克/立方米;STEL 0.63 毫克/立方米
  • 刺激数据:皮肤-兔子810 毫克/24小时 中度;眼睛-兔子 500 毫克/24小时 轻度
  • 爆炸物危险特性:与氧化剂反应激烈
  • 六氯-1,3-丁二烯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80067982 六氯-1.3-丁二烯 250ml 40元 2011/08/23 80067980 六氯-1.3-丁二烯 250ml 74.8元 2010/05/25 A17316 六氯-1,3-丁二烯, 97% Hexachloro-1,3-butadiene, 97% 50g 346元
  • 用途一:用作溶剂、热载体、热交换剂、水力系统用液体、洗液,也用于合成橡胶工业
  • 挥发性有机化合物(VOCs)单组分标准液
  • 蒸气压:0.2 mm Hg ( 20 °C)
  • MSDS 信息:六氯-1,3-丁二烯(87-68-3).msds
  • 类别:农药
  • 稍有特殊气味。不溶于水,溶于醇、醚。
  • Sigma Aldrich:87-68-3(sigmaaldrich)
  • 可燃性危险特性:高温, 明火可燃烧; 燃烧释放有毒氯化物烟雾
  • 稍有特殊气味。不溶于水,溶于醇、醚
  • 图谱信息:六氯-1,3-丁二烯(87-68-3)质谱(MS) 六氯-1,3-丁二烯(87-68-3)红外图谱(IR2) 六氯-1,3-丁二烯(87-68-3)核磁图( 13 CNMR) 六氯-1,3-丁二烯(87-68-3)Raman光谱 六氯-1,3-丁二烯(87-68-3)红外图谱(IR1)
  • 外观性质:无色至淡黄色液体,稍有特殊气味。
  • 急性毒性:口服-大鼠 LD50: 82 毫克/公斤;口服-小鼠 LD50: 87 毫克/公斤
  • 毒性分级:高毒
  • 灭火剂:雾状水、泡沫、二氧化碳、砂土。
  • Alfa Aesar:六氯-1,3-丁二烯,97% Hexachloro-1,3-butadiene, 97%(87-68-3)
  • Acros Organics:六氯-1,3-丁二烯 Hexachloro-1,3-butadiene, 98%(87-68-3)

系列性分类


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