1,2,3-Tri-n-Octanoylglycerol 三辛酸甘油酯

CAS 538-23-8 MFCD00036236

化学结构图

538-23-8
SMILES: CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC

化学属性

Mol. FormulaC27H50O6
Mol. Weight470.68
Density0.956 g/mL at 20 °C(lit.)
Boiling Point234°C/1mmHg(lit.)
Melting Point9-10 °C
Refractive index1.4470 to 1.4500
Flash Point225°C(lit.)

别名和识别编码

Chemical Name1,2,3-Tri-n-Octanoylglycerol
Synonym 1,2,3-TRIOACTANOYLGLYCEROL 1,2,3-TRIOCTANOYLGLYCEROL 1,2,3-Tricapryloylglycerol 1,2,3-Tricapryloylglycerol 1,2,3-三辛酰甘油 Glycerol trioctanoate Trioctanoin 三辛精 甘油三辛酸酯 甘油基三辛酸酯 1,2,3-tris-(octanoyloxy)-propane 1,2,3-tris-octanoyloxy-propane 1,2,3-三辛酰甘油 2,3-Bis(octanoyloxy)propyl octanoate 8:0TG AKOMED R/E CAPRYLIC ACID TRIGLYCERIDE CAPRYLIN Caprylic acid triglyceride Caprylic triglyceride Caprylin- EMALEX OTG GLYCERINTRICAPRYLATE GLYCEROL TRI-N-OCTANOATE GLYCEROL TRICAPRYLATE GLYCERYL TRICAPRYLATE GLYCERYL TRIOCTANOATE Glycerintricaprylat Glycerol tricaprylate Glycerol trioctanoate Glycerol-trioctanoate T
MDL NumberMFCD00036236
CAS Number538-23-8
PubChem Substance ID10850
Beilstein Registry Number1717202
EC Number208-686-5
Reaxys-RN1717202
Chemical Name Translation三辛酸甘油酯
Wiswesser Line Notation7VO1YOV7&1OV7
LabNetwork Molecule IDLN00196258
InChIInChI=1S/C27H50O6/c1-4-7-10-13-16-19-25(28)31-22-24(33-27(30)21-18-15-12-9-6-3)23-32-26(29)20-17-14-11-8-5-2/h24H,4-23H2,1-3H3
Canonical SMILESCCCCCCCC(OCC(OC(CCCCCCC)=O)COC(CCCCCCC)=O)=O
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分类

  • {SNA} Biochemicals and Reagents, Glycerolipid Metabolism, Glycerolipids, Lipids, Metabolic Pathways, Triacylglycerols, 代谢组学, 细胞生物学
  • {SA} Biochemicals and
  • {uni_hamburg} no charge; ester; 1fragment
  • {SNA} Building Blocks, C12 to C63, Carbonyl Compounds, Chemical Synthesis, Esters, Glycerolipids, Organic Building Blocks, Triacylglycerols, 生化试剂, 脂类
  • {SNA} Bioche
  • {SNA} Biochemicals and Reagents, Cell Biology, Glycerolipid Metabolism, Glycerolipids, Lipids, Metabolic Pathways, Metabolomics,

相关文献及参考

  • [2]. Kwok MK, et al. Re-thinking Alzheimer's disease therapeutic targets using gene-based tests. EBioMedicine. 2018 Nov;37:461-470.
  • Short: III/38A Title: Refractive Indices of Inorganic, Organometallic, and Organononmetallic Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38A Year: 1996 Keyword: organicmetallic compounds; inorganic compounds; refractive index; liquids; mixtures ISBN: 3-540-60539-8 ISBN: 978-3-540-60539-3 Internet Resource: DOI:10.1007/b55612 RefComment: VII, 400 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 organ

安全信息

RTECSYJ7700000
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves
Storage condition 2-8°C
Safety Statements
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2600 mL/kg/2Y-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Gastrointestinal - tumors
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-426,1994

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >27800 mg/kg
TOXIC EFFECTS :
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 4,871,1970

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >27800 mg/kg
TOXIC EFFECTS :
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 4,871,1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3700 mg/kg
TOXIC EFFECTS :
   Behavioral - muscle contraction or spasticity
REFERENCE :
   APSCAX Acta Physiologica Scandinavica.  (Karolinska Institutet, S-10401
   Stockholm, Sweden) V.1-    1940-  Volume(issue)/page/year: 40,338,1957

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 4 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 33300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 4,871,1970

TYPE

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 250 gm/kg
SEX/DURATION            : female 7 day(s) pre-mating  - 21 day(s) post-birth
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - weaning or lactation index (e.g., #
   alive at weaning per # alive at day 4)
   Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight
   gain)
REFERENCE :
   IYKEDH Iyakuhin Kenkyu.  Study of Medical Supplies.  (Nippon Koteisho
   Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan)  V.1- 1970- 
   Volume(issue)/page/year: 3,180,1972

其他信息

  • TCI Shanghai:三辛酸甘油酯 Tricaprylin,>;93.0%(GC)(538-23-8)
  • MOL 文件:538-23-8.mol
  • 用途一:用于护肤品及化妆品中
  • 三辛酸甘油酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T0365 三辛酸甘油酯 Tricaprylin 25ML 240元 2010/06/21 422110250 三辛酸甘油酯 Trioctanoin 98% 25 GR 213元 2010/06/21 422115000 三辛酸甘油酯 Trioctanoin 98% 500 GR 1568元
  • Acros Organics:三辛酸甘油酯 Trioctanoin, 98%(538-23-8)

系列性分类

  1. Life Science 生命科学
  2. Metabolomics 代谢组学
  3. Metabolic Pathways - Metabolomics
  4. Glycerolipid Metabolism - Metabolic Pathways
  1. Life Science 生命科学
  2. Biochemicals and Reagents 生化试剂
  3. Lipids - Biochemicals and Reagents
  4. Glycerolipids - Lipids
  5. Triacylglycerols - Glycerolipids
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C12 to C63 - Esters
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters
  6. C10 to C11
  1. Life Science 生命科学
  2. Biochemicals and Reagents
  3. Lipids
  4. Glycerides
  5. Neutral Glycerides
  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)

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