Trimethylene Oxide 氧杂环丁烷

CAS 503-30-0 MFCD00005167

化学结构图

503-30-0
SMILES: C1COC1

化学属性

Mol. FormulaC3H6O
Mol. Weight58
Refractive index1.3920 to 1.3940
Boiling Point50
Density0.893
Flash Point-28°C(lit.)
TSCAYes
Melting Point-97
Vapor Pressure5.09 psi ( 20 °C)

别名和识别编码

Chemical NameTrimethylene Oxide
Synonym 1,3-EPOXYPROPAN 1,3-EPOXYPROPANE 1,3-Epoxypropane, Oxetane 1,3-Propylene oxide 1,3-Propylenoxid 1,3-TRIMETHYLENE OXIDE 1,3-Trimethylenoxid 1,3-环氧丙烷 1,3-環氧丙烷 3-AMINOMETHYL PHENYL SULFONE Cyclooxabutane OXECTANE OXETANE Oxacyclobutane Oxetan Oxetane Oxetane; 1,3-Epoxypropane Oxytrimethylene Propane, 1,3-epoxy- TRIMETHYLENE OXIDE Trimethylene oxide Trimethyleneoxide,97% Trimethyleneoxide,99% Trimethylenoxyd oxetane trimethylene oxide α,γ-Propane oxide 三甲撑氧 三甲氧基酯 氧杂环丁烷
CAS Number503-30-0
PubChem Substance ID10423
EC Number207-964-3
Beilstein Registry Number102382
MDL NumberMFCD00005167
Reaxys-RN102382
Merck Number9715
Chemical Name Translation氧杂环丁烷
Wiswesser Line NotationT4OTJ
LabNetwork Molecule IDLN01746438
InChIInChI=1S/C3H6O/c1-2-4-3-1/h1-3H2
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分类

  • {SA} Asymmetric Synthesis, Building Blocks, Chemical Synthesis, Chiral Building Blocks, Heterocyclic Building Blocks, Oxetanes
  • {SNA} Asymmetric Synthesis, Building Blocks, Chemical Synthesis, Chiral Building Blocks, Heterocyclic Building Blocks, Oxetanes
  • {uni_hamburg} no charge; oxygen heterocycle; alicycle; 4ring; ether; 1fragment

相关文献及参考

  • Short: II/22b
  • {
  • Reaction with K metal: 18-crown-6 complex provides a one pot metallation reaction yielding a comparatively stable product for use in further metallation reactions: J. Chem. Soc., Chem. Commun., 1513 (1991).
  • Short: II/14a
  • Short: II/25C
  • 3-Carbon fragment, useful for the synthesis of 3-substituted propanols by reaction with Grignards: J. Am. Chem. Soc., 73, 124 (1951), or organolithiums in the presence of CuBr: Tetrahedron Lett., 1095 (1976).

安全信息

GHS Symbol
WGK Germany1
Hazard Codes 3 F,Xn Xn;F
Hazard statements
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
  • H332 Harmful if inhaled 吸入有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)
RTECSRQ6825000
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。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241+P242+P243
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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+P312+P330
  • P302+P352+P312+P362+P364
  • P303+P361+P353
  • P370+
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number 1993 UN 1993 3/PG 2
Storage condition 0-10 0-10°C 2-8°C
Risk Statements
  • R11 Highly flammable 非常易燃
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
  • 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；
  • S29 Do not empty into drains 不要排入下水道；
  • S9 Keep container in a well-ventilated place 保持容器在通风良好的场所；
Packing GroupII
Hazard Class3 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2240 mg/kg/56W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   ZEKBAI Zeitschrift fuer Krebsforschung.  (Berlin, Fed. Rep. Ger.)  V.1-75,
   1903-71.  For publisher information, see JCROD7.  Volume(issue)/page/year:
   74,241,1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZEKBAI Zeitschrift fuer Krebsforschung.  (Berlin, Fed. Rep. Ger.)  V.1-75,
   1903-71.  For publisher information, see JCROD7.  Volume(issue)/page/year:
   74,241,1970

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 3333 ug/plate
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:
   11(Suppl 12),1,1988

其他信息

  • MOL 文件:503-30-0.mol
  • 蒸气压:5.09 psi ( 20 °C)
  • 下游产品:聚[3,3-双(氯甲基)氧杂环丁烷]系塑料热电薄膜
  • 三甲氧基酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 140140250 三甲氧基酯 Trimethylene oxide 97% 25 ML 3913元 2010/05/25 A14452 三甲撑氧, 97% Trimethylene oxide, 97% 5g 594元 2010/05/25 A14452 三甲撑氧, 97% Trimethylene oxide, 97% 25g 2646元
  • TCI Shanghai:1,3-环氧丙烷 Trimethylene Oxide,>;98.0%(GC)(503-30-0)
  • Alfa Aesar:三甲撑氧,97% Trimethylene oxide, 97%(503-30-0)
  • Sigma Aldrich:503-30-0(sigmaaldrich)
  • 图谱信息:三甲氧基酯(503-30-0)核磁图( 1 HNMR) 三甲氧基酯(503-30-0)核磁图( 13 CNMR) 三甲氧基酯(503-30-0)红外图谱(IR1) 三甲氧基酯(503-30-0)质谱(MS)
  • Acros Organics:Trimethylene oxide, 97%(503-30-0)
  • F:3-10-23

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  5. O-Containing - Others
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Oxetanes - Heterocyclic Building Blocks
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  5. N-Containing
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Simple 4-Membered Ring Compounds