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MedKoo Cat#: 581877 | Name: Trimethylolpropane caprate

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Trimethylolpropane caprate has developmental toxicity in Sprague-Dawley rats.

Chemical Structure

Trimethylolpropane caprate
Trimethylolpropane caprate
CAS#78-17-1

Theoretical Analysis

MedKoo Cat#: 581877

Name: Trimethylolpropane caprate

CAS#: 78-17-1

Chemical Formula: C36H68O6

Exact Mass: 596.5016

Molecular Weight: 596.93

Elemental Analysis: C, 72.44; H, 11.48; O, 16.08

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
Bulk Inquiry
Related CAS #
No Data
Synonym
Trimethylolpropane caprate; Trimethylolpropane tricaprate; Trimethylolpropane tridecanoate; UNII-X307CM75YF.
IUPAC/Chemical Name
2-((decanoyloxy)methyl)-2-ethylpropane-1,3-diyl bis(decanoate)
InChi Key
QQGBDFMKLXCNHD-UHFFFAOYSA-N
InChi Code
InChI=1S/C36H68O6/c1-5-9-12-15-18-21-24-27-33(37)40-30-36(8-4,31-41-34(38)28-25-22-19-16-13-10-6-2)32-42-35(39)29-26-23-20-17-14-11-7-3/h5-32H2,1-4H3
SMILES Code
O=C(OCC(CC)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC)CCCCCCCCC
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 596.93 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Azuka C, Daston GP. Developmental toxicity evaluation of trimethylolpropane caprylate caprate in Sprague-Dawley rats. Birth Defects Res B Dev Reprod Toxicol. 2004 Dec;71(6):374-9. PubMed PMID: 15617023.