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 Tricaprilin {Chemicalbook} 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- {} {Chemicalbook} 1,2,3
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 {LY} 2-8°C {} {Chemicalbook} 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


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