2-Methyl-2-Nitro-1,3-Propanediol 2-硝基-2-甲基-1,3-丙二醇

CAS 77-49-6 MFCD00024812

化学结构图

77-49-6
SMILES: CC(CO)(CO)[N+](=O)[O-]

化学属性

Mol. FormulaC4H9NO4
Mol. Weight135.11856
Melting Point148-151 °C
TSCAYes
Boiling Point248.79 °C at 760 mmHg

别名和识别编码

Chemical Name2-Methyl-2-Nitro-1,3-Propanediol
Synonym 2-Methyl-2-nitropropane-1,3-diol {LY} 2-Methyl-2-nitropropane-1,3-diol {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-nitropropane-1,3-diol {} {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00024812
CAS Number77-49-6
EC Number201-031-4
Chemical Name Translation2-硝基-2-甲基-1,3-丙二醇
Reaxys-RN1762621
Beilstein Registry Number1(4)2537
PubChem Substance ID6480
Wiswesser Line NotationWNX1&1Q1Q
LabNetwork Molecule IDLN00243703
InChIInChI=1S/C4H9NO4/c1-4(2-6,3-7)5(8)9/h6-7H,2-3H2,1H3
Canonical SMILESOCC([N+]([O-])=O)(C)CO
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分类

  • {uni_hamburg} no charge; alcohol; 1fragment

相关文献及参考

  • Short: IV/8A Title: Enthalpies of Fusion and Transition of Organic Compounds Author: Zhang, Z.-Y.; Frenkel, M.; March, K.N.; Wilhoit, R.C. Editor: Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8A Year: 1995 Keyword: organic compounds; enthaly of fusion; melting point; phase transition ISBN: 3-540-58854-X ISBN: 978-3-540-58854-2 Internet Resource: DOI:10.1007/b55145 RefComment: VIII, 588 pages.
  • 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

RTECSTY8925000
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
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
Signal word
Hazard statements
  • H303 May be harmfully swallowed 吞食可能有害
  • 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
Precautionary statements
  • 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。
  • 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。
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • 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)。
  • P332+P313
  • P337+P313
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2 gm/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - coma
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information,

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6300 uL/kg
TOXIC EFFECTS :
   Skin and Appendages - dermatitis, allergic (after systemic exposure)
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 93,26,1948

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >10 mL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 93,26,1948

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - coma
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information, see AEHLAU.
   Volume(issue)/page/year: 22,315,1940

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 图谱信息:2-硝基-2-甲基-1,3-丙二醇(77-49-6)质谱(MS) 2-硝基-2-甲基-1,3-丙二醇(77-49-6)核磁图( 13 CNMR) 2-硝基-2-甲基-1,3-丙二醇(77-49-6)红外图谱(IR1) 2-硝基-2-甲基-1,3-丙二醇(77-49-6)红外图谱(IR2)
  • MOL 文件:77-49-6.mol
  • Acros Organics:2-硝基-2-甲基-1,3-丙二醇 2-Nitro-2-methyl-1,3-propanediol, 99%(77-49-6)
  • Alfa Aesar:2-甲基-2-硝基-1,3-丙烷二醇,97% 2-Methyl-2-nitro-1,3-propanediol, 97%(77-49-6)
  • Sigma Aldrich:77-49-6(sigmaaldrich)
  • 2-硝基-2-甲基-1,3-丙二醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0639 2-甲基-2-硝基-1,3-丙二醇 2-Methyl-2-nitro-1,3-propanediol 5G 592元 2014/06/02 M0639 2-甲基-2-硝基-1,3-丙二醇 2-Methyl-2-nitro-1,3-propanediol 25G 1180元 2010/06/21 134800050 2-硝基-2-甲基-1,3-丙二醇 2-Nitro-2-methyl-1,3-propanediol 99% 5 GR 841元
  • TCI Shanghai:2-甲基-2-硝基-1,3-丙二醇 2-Methyl-2-nitro-1,3-propanediol,>;98.0%(N)(77-49-6)
  • 2-硝基-2-甲基-1,3-丙二醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 M0639 2-甲基-2-硝基-1,3-丙二醇 2-Methyl-2-nitro-1,3-propanediol 5G 489元 2011/04/16 M0639 2-甲基-2-硝基-1,3-丙二醇 2-Methyl-2-nitro-1,3-propanediol 25G 966元 2010/06/21 134800050 2-硝基-2-甲基-1,3-丙二醇 2-Nitro-2-methyl-1,3-propanediol 99% 5 GR 841元

系列性分类


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