1,3,5-Cycloheptatriene 环庚三烯

CAS 544-25-2 MFCD00004146

化学结构图

544-25-2
SMILES: C1=CC=CCC=C1

化学属性

Mol. FormulaC7H8
Mol. Weight92
Refractive index1.5210 to 1.5250
Boiling Point115°C
Density0.888 g/mL at 25 °C(lit.)
Flash Point4°C(lit.)
TSCANo
Melting Point-80°
Solubility不溶

别名和识别编码

Chemical Name1,3,5-Cycloheptatriene
Synonym 1,3,5-CYCLOHEPTATRIENE 1,3,5-Cycloheptariene 1,3,5-Cycloheptatriene; CHT; Tropilidene 1,3,5-cycloheptatriene 1,3,5-氯酚 1,3,5-环庚三烯 1,3,5-環庚三烯 1，3，5-Cycioheptatriene CHT CYCLOHEPTATRIENE CYCLOHEPTATRIENE, STANDARD FOR GC Cyclohepta-1,3,5-triene Cyclohepta-2,4,6-triene Cycloheptatrien Cycloheptatriene,tech.90% Cycloheptatrienetech TROPILIDENE Tropiliden Tropilidene Tropilidin Tropyliden Tropylidene cyclohepatriene cyclohepta-1,3,5-triene cycloheptatriene tropiliden tropilidine 【草(之上)+卓】 环庚三烯 環庚三烯 芳庚
MDL NumberMFCD00004146
CAS Number544-25-2
PubChem Substance ID11000
EC Number208-866-3
Beilstein Registry Number5,280
Reaxys-RN506066
Chemical Name Translation环庚三烯
InChIKeyCHVJITGCYZJHLR-UHFFFAOYSA-N
Wiswesser Line NotationL7 AHJ
LabNetwork Molecule IDLN00202079
InChIInChI=1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2
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分类

  • {uni_hamburg} no charge; carbocycle; alicycle; large ring; 7ring; 1fragment
  • {SNA} Alkanes, Building Blocks, Chemical Synthesis, Cyclic, Organic Building Blocks

相关文献及参考

  • Short: II/19b Title: Molecular Constants: Rotational, Centrifugal Distortion and Related Constants of Diamagnetic Asymmetric Top Molecules Author: Demaison, J.; Hüttner, W.; Vogt, J.; Wlodarczak, G. Editor: Hüttner, W. Source: Landolt-Börnstein, New Series Volume: II/19b Year: 1992 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-54578-6 ISBN: 978-3-540-54578-1 Internet Resource: DOI:10.1007/b44334 RefComment: XI, 488 pages. Abstract: Volume II/19 Molecular Constants mostly from Microwave, Molecular Beam and Sub-Doppler Laser Spectroscopy is a supplement to the earlier volumes II/4, II/6, and II/14. The slight change in the title reflects current trends in the applications of spectroscopic methods. Together, the four volumes collect all the critically evaluated data published up to 1989/90 on constants of free molecules obtained by classical and modern spectroscopy. Volume II/19 is divided into four parts to record the growing number of investigations, especially in the microwave and millimeter wave regions, where modern techniques like Fourier Transform Microwave Spectroscopy have made new objects of interest such as molecular complexes and clusters accessible to study. Subvolume II/19b contains corresponding data on diamagnetic asymmetric top molecules.
  • Short: II/25D Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More Carbon Atoms Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.; Vogt, N. Editor: Kuchitsu, K. Source: Landolt-Börnstein, New Series Volume: II/25D Year: 2003 Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules ISBN: 3-540-42860-7 ISBN: 978-3-540-42860-2 Internet Resource: DOI:10.1007/b75952 RefComment: VIII, 569 pages. Hardcover RefComment: Written for scientists and researchers in the fields of chemistry and physics Abstract: This fourth subvolume presents data on the geometric parameters (internucl

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
  • H301 Toxic if swallowed 吞食有毒
  • H301+H311
  • H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
  • H311 Toxic in contact with skin 皮肤接触中毒
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSGU3675000
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P241+P242+P243
  • P242 Use only non-sparking tools. 只能使用无火花工具。
  • P243 Take precautionary measures against static discharge. 采取预防措施，防止静电放电。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P301+P310
  • P301+P310+P330
  • P301+P310+P331+P330
  • P302+P352
  • P302+P352+P312+
  • P303+P361+P353
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P331 Do NOT induce vomiting.. 不要催吐。
  • P332+P313
  • P337+P313
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P370+P378
  • P403+P233
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Packing GroupII
UN Number UN 2603 3/PG 2 2603 UN2603
Risk Statements
  • R11 Highly flammable 非常易燃
  • R25 Toxic if swallowed 吞咽有毒
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R65 Harmful: may cause lung damage if swallowed 若吞咽可能伤害肺部器官
  • R21 Harmful in contact with skin 与皮肤接触有害
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label where possible 吞食后不要催吐：立即求医并出示该容器或标签；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S33 Take precautionary measures against static discharges 对静电采取预防措施；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Hazard Codes F,T F;T
Hazard Class3/6.1
Storage condition 0-10°C 2-8°C
Warnings 危化品目录(2015) 危险化学品 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 171 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Vascular - regional or general arteriolar constriction
   Blood - hemorrhage
REFERENCE :
   AOHYA3 Annals of Occupational Hygiene.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958- Volume(issue)/page/year:
   10,123,1967

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 57 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Vascular - regional or general arteriolar constriction
   Blood - hemorrhage
REFERENCE :
   AOHYA3 Annals of Occupational Hygiene.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958- Volume(issue)/page/year:
   10,123,1967

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 442 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AOHYA3 Annals of Occupational Hygiene.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958- Volume(issue)/page/year:
   10,123,1967

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 100 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 153,57,1985

其他信息

  • 可燃性危险特性:易燃
  • 爆炸物危险特性:与空气混合形成爆炸性混合物;
  • 图谱信息:环庚三烯(544-25-2)核磁图( 1 HNMR) 环庚三烯(544-25-2)红外图谱(IR1) 环庚三烯(544-25-2)核磁图( 13 CNMR) 环庚三烯(544-25-2)质谱(MS)
  • 灭火剂:泡沫, 干粉, 二氧化碳, 砂土
  • 类别:易燃液体
  • TCI Shanghai:1,3,5-环庚三烯 1,3,5-Cycloheptatriene,>;95.0%(GC)(544-25-2)
  • F:10-23
  • MSDS 信息:环庚三烯(544-25-2).msds
  • Sigma Aldrich:544-25-2(sigmaaldrich)
  • MOL 文件:544-25-2.mol
  • 外观性质:无色至暗黄色液体，在空气中久置能成树脂样物质。
  • 环庚三烯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0572 1,3,5-环庚三烯 1,3,5-Cycloheptatriene 25ML 403元 2010/05/25 A17064 环庚三烯, 95% Cycloheptatriene, 95% 50ml 305元 2010/05/25 A17064 环庚三烯, 95% Cycloheptatriene, 95% 250ml 1322元
  • Alfa Aesar:环庚三烯,95% Cycloheptatriene, 95%(544-25-2)
  • 储运特性:库房通风低温干燥; 与氧化剂分开储运存放
  • 用途一:工业上可用于印刷机清洗剂
  • 海关编码:29021990

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkanes 烷烃
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkenes 烯烃
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. C - Alphabetic
  5. CO - CZ - C
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkanes 烷烃
  5. Cyclic - Alkanes

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