Abietic acid, dihydro-, triester with glycerol
TL;DR: Abietic acid, dihydro-, triester with glycerol (CAS 125-93-9) is a chemical compound with molecular formula C63H98O6 and molecular weight 950.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy]propyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate
Also Known As: Tridihexethyl iodide, Abietic acid, dihydro-, triester with glycerol, 2,3-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy]propyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate, Propane-1,2,3-triyl triabiet-8(14)-en-18-oate, 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, 1,2,3-propanetriyl ester, (1R-(1alpha,4abeta,4balpha,10aalpha))-
| Molecular Formula | C63H98O6 |
|---|---|
| Molecular Weight | 950.74 g/mol |
| LogP | 17.2 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 950.7363 |
| Heavy Atoms | 69 |
| Complexity | 1950.0 |
Chemical Identifiers
| CAS Number | 125-93-9 |
|---|---|
| SMILES | CC(C)C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)OCC(COC(=O)C4(CCCC5(C4CCC6=CC(CCC65)C(C)C)C)C)OC(=O)C7(CCCC8(C7CCC9=CC(CCC98)C(C)C)C)C)C |
| InChIKey | KZAOFYDFGRIAQU-UHFFFAOYSA-N |
Product Overview
Abietic acid, dihydro-, triester with glycerol (CAS 125-93-9), with molecular formula C63H98O6 and molecular weight 950.74 g/mol. IUPAC: 2,3-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy]propyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate.
Chemical Property Profile of Abietic acid, dihydro-, triester with glycerol
Property Insights of Abietic acid, dihydro-, triester with glycerol
The XLogP value of 17.2 indicates that Abietic acid, dihydro-, triester with glycerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Abietic acid, dihydro-, triester with glycerol. Following Lipinski's Rule of Five, Abietic acid, dihydro-, triester with glycerol has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Abietic acid, dihydro-, triester with glycerol?
The CAS number of Abietic acid, dihydro-, triester with glycerol is 125-93-9.
What is the molecular formula of Abietic acid, dihydro-, triester with glycerol?
The molecular formula of Abietic acid, dihydro-, triester with glycerol is C63H98O6.
What is the molecular weight of Abietic acid, dihydro-, triester with glycerol?
The molecular weight of Abietic acid, dihydro-, triester with glycerol is 950.74 g/mol.
Where can I buy Abietic acid, dihydro-, triester with glycerol?
You can request a quote for Abietic acid, dihydro-, triester with glycerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Abietic acid, dihydro-, triester with glycerol?
Yes, KEHONG BIO provides custom synthesis services for Abietic acid, dihydro-, triester with glycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.