1,3-Butanediol, 2-methyl- 2-甲基丁烷-1,3-二醇

CAS 684-84-4 MFCD00684844

化学结构图

684-84-4
SMILES: CC(O)C(C)CO

化学属性

Mol. FormulaC5H12O2
Mol. Weight104.15
Melting Point50.86 °C
Boiling Point209.24 °C at 760 mmHg

别名和识别编码

Synonym 2-Methylbutane-1,3-diol {LY} 2-Methylbutane-1,3-diol {} {LY} 2-Methylbutane-1,3-diol {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbutane-1,3-diol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
InChIKeyGNBPEYCZELNJMS-UHFFFAOYSA-N
Chemical Name1,3-Butanediol, 2-methyl-
Wiswesser Line NotationQ1Y1&YQ1
CAS Number684-84-4
Beilstein Registry Number1732163
PubChem Substance ID12698
InChIInChI=1S/C5H12O2/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3
Chemical Name Translation2-甲基丁烷-1,3-二醇
Canonical SMILESCC(O)C(C)CO
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分类

  • {uni_hamburg} no charge; alcohol; 1fragment

相关文献及参考

  • Short: IV/20B Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R. Source: Landolt-Börnstein, New Series Volume: IV/20B Year: 2000 Keyword: organic compounds; vapor pressure ISBN: 3-540-64968-9 ISBN: 978-3-540-64968-7 Internet Resource: DOI:10.1007/b71424 RefComment: VII, 320 pages.
  • Short: IV/8G Title: Densities of Alcohols Author: Frenkel, M.; Hong, X.; Wilhoit, R.C.; Hall, K.R. Editor: Hall, K.R.; Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8G Year: 2000 Keyword: organic compounds; density; liquids ISBN: 3-540-66233-2 ISBN: 978-3-540-66233-4 Internet Resource: DOI:10.1007/b75928 RefComment: XI, 413 pages, with CD-ROM, Hardcover

安全信息

RTECSEK2200000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 15700 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und
   Pharmakologie.  (Berlin, Ger.) V.110-253, 1925-66.  For publisher
   information, see NSAPCC.  Volume(issue)/page/year: 228,367,1956

Hazard statements
  • H318 Causes serious eye damage 严重伤害眼睛
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。
  • P305+P351+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
Storage condition

系列性分类

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