delta-Dodecalactone 天然丁位十二内酯

CAS 713-95-1 MFCD00006651

化学结构图

713-95-1
SMILES: CCCCCCCC1CCCC(=O)O1

化学属性

Mol. FormulaC12H22O2
Mol. Weight198.31
Density0.942
Refractive index1.4590 to 1.4610
Flash Point119.8±15.9°C
TSCAYes
Boiling Point295.2±8.0°C at 760 mmHg
Melting Point-12°C

别名和识别编码

Chemical Namedelta-Dodecalactone
MDL NumberMFCD00006651
CAS Number713-95-1
Synonym 6-Heptyltetrahydro-2H-pyran-2-one {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} { {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Heptyltetrahydro-2H-pyran-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number211-932-4
Beilstein Registry Number1282749
PubChem Substance ID12844
Reaxys-RN1282749
Chemical Name Translation天然丁位十二内酯
Wiswesser Line NotationT6OVTJ F7
LabNetwork Molecule IDLN00222740
InChIInChI=1S/C12H22O2/c1-2-3-4-5-6-8-11-9-7-10-12(13)14-11/h11H,2-10H2,1H3
Canonical SMILESCCCCCCCC1CCCC(O1)=O
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分类

  • {SNA} A - D,
  • {SNA} A -
  • {SNA} A - D, A-D, Alphabetical Listings, C-D, Certified Food Grade Products, Flavors and Fragrances, Follows IFRA Guidelines, Food Safe Elite, Halal Certified Products, Kosher Certified Products
  • {SNA} A - D, A-D, Alphabetical Listings, C-D, Certified Food Grade Products, Certified Natural Products, Flavors and Fragrances, Follows IFRA Guidelines, Halal Certified Products, Kosher Certified Products
  • {SNA} A-D, Alphabetical Listings, C-D, Certified Food Grade Products, Certified Natural Products,

相关文献及参考

  • Merck: 14,10284
  • Merck: 14,10284 Beilstein: 17,V,9,100

安全信息

RTECSUQ0850000
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
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;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
GHS Symbol
WGK Germany2
Hazard statements
  • 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, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
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。
  • 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
  • P305+P351+P338+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
Signal word Warning
Hazard Codes Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,773,1979

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,773,1979

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 不溶于水,易溶于醇类有机溶剂。有浓甜桃子样果香、微带奶油味。

系列性分类