2-Chlorobenzoxazole 2-氯苯并恶唑

CAS 615-18-9 MFCD00005766

化学结构图

615-18-9
SMILES: Clc1nc2ccccc2o1

化学属性

Mol. FormulaC7H4ClNO
Mol. Weight153.57
Refractive index1.5650 to 1.5680
Boiling Point201.5°C at 760 mmHg
Density1.345 g/mL at 25 °C(lit.)
Melting Point7°C
Flash Point85°C(lit.)
TSCAYes

别名和识别编码

Chemical Name2-Chlorobenzoxazole
CAS Number615-18-9
Alfabeta NameCHLOROBENZOXAZOLE 2-
MDL NumberMFCD00005766
PubChem Substance ID11986
EC Number210-414-5
Beilstein Registry Number27(2)17
Reaxys-RN115982
Synonym 2-Chlorobenzoxazole {LY} 2-Chlorobenzoxazole {} {LY} 2-Chlorobenzoxazole {} {} {LY} 2-Chlorobenzoxazole {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobenzoxazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chlorobe
Chemical Name Translation2-氯苯并恶唑
Wiswesser Line NotationT56 BN DOJ CG
InChIKeyBBVQDWDBTWSGHQ-UHFFFAOYSA-N
LabNetwork Molecule IDLN00005074
InChIInChI=1S/C7H4ClNO/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H
Canonical SMILESClC1=NC2=CC=CC=C2O1
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分类

  • {SA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Oxazoles
  • Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Oxazoles
  • {uni_hamburg} no charge; oxygen heterocycle; nitrogen heterocycle; carbocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Oxazoles

相关文献及参考

  • Beil. 27 ,II,17
  • Corp MSDS 1 (1), 746:B / FT-NMR 1 (3), 197:C / RegBook 1 (2), 2451:A / Sax 6 , 683 / Structure Index 1 , 388:E:1 / Vapor Phase 3 , 1510:C
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Hazard Codes Xn
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H227 Combustible liquid 可燃液体
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSDM4680000
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P332+P313
  • P305+P351+P338+P337+P313
  • P301+P312+P330
  • 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。
  • P302+P352+P332+P313+P362+P364
  • P302+P350
  • P403+P235
Signal word Warning
Storage condition -20°C {LY} -20°C 0-10 0-10°C 2-8°C {} {LY} -20°C {} {} {LY} -20°C {} {} {} {LY} -20°C {} {} {} {} {LY} -20°C {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -2
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
Safety Statements
  • 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;
  • 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;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   MDCHAG Medicinal Chemistry: A Series of Monographs.  (Academic Press, Inc.,
   1 E. First St., Duluth, MN 55802)  V.1-    1963-  Volume(issue)/page/year:
   4(1),337,1964

其他信息

  • Sigma Aldrich:615-18-9(sigmaaldrich)
  • 类别:有毒物质
  • 灭火剂:水,二氧化碳, 泡沫, 干粉
  • 图谱信息:2-氯苯并恶唑(615-18-9)红外图谱(IR1) 2-氯苯并恶唑(615-18-9)质谱(MS) 2-氯苯并恶唑(615-18-9)核磁图( 13 CNMR) 2-氯苯并恶唑(615-18-9)核磁图( 1 HNMR)
  • 急性毒性:口服-小鼠 LD50: 2000 毫克/公斤
  • MSDS 信息:2-Chlorobenzoxazole(615-18-9).msds
  • 毒性分级:中毒
  • Alfa Aesar:2-氯苯并唑,99% 2-Chlorobenzoxazole, 99%(615-18-9)
  • Acros Organics:2-氯苯并唑 2-Chlorobenzoxazole, 99%(615-18-9)
  • 2-氯苯并恶唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 C1387 2-氯苯并恶唑 2-Chlorobenzoxazole 5G 457元 2011/04/16 C1387 2-氯苯并恶唑 2-Chlorobenzoxazole 25G 1260元 2010/06/21 404530100 2-氯苯并恶唑 2-Chlorobenzoxazole 99% 10 GR 1188元
  • 上游原料:乙醇 --> 乙酸 --> 甲苯 --> 氢氧化钾 --> 五氯化磷 --> 二硫化碳 --> 活性炭 --> 2-氨基苯酚
  • 可燃性危险特性:遇热明火可燃; 热分解排出有毒氮氧化物, 氯化物烟雾
  • F:10
  • TCI Shanghai:2-氯苯并恶唑 2-Chlorobenzoxazole,>;98.0%(GC)(615-18-9)
  • MOL 文件:615-18-9.mol
  • 储运特性:库房低温通风干燥; 防明火
  • 2-氯苯并恶唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C1387 2-氯苯并恶唑 2-Chlorobenzoxazole 5G 433元 2014/06/02 C1387 2-氯苯并恶唑 2-Chlorobenzoxazole 25G 1200元 2010/06/21 404530100 2-氯苯并恶唑 2-Chlorobenzoxazole 99% 10 GR 1188元

系列性分类


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