2-oxa-3-deoxy-25-hydroxyvitamin D3
TL;DR: 2-oxa-3-deoxy-25-hydroxyvitamin D3 (CAS 113490-39-4) is a chemical compound with molecular formula C26H42O2 and molecular weight 386.31848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R)-6-[(1R,3aS,4E,7aR)-7a-methyl-4-[(2Z)-2-(3-methylideneoxan-4-ylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptan-2-ol
Also Known As: 2-Oxa-3-deoxy-25-OH-D3, 2-Oxa-3-deoxy-25-hydroxyvitamin D3, 25-Hydroxy-2-oxa-3-deoxycholecalciferol, (5Z,7E)-2-oxa-9,10-seco-5,7,10(19)-cholestatrien-25-ol, (6R)-6-[(1R,3aS,4E,7aR)-7a-methyl-4-[(2Z)-2-(3-methylideneoxan-4-ylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptan-2-ol
Technical Specifications
| Molecular Formula | C26H42O2 |
| Molecular Weight | 386.31848 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.31848 Da |
| Heavy Atoms | 28 |
| Complexity | 626.0 |
| SMILES | C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\CCOCC3=C)C |
| InChIKey | CCFSYRQFWNVGDG-SDPFTLJPSA-N |
Chemical Property Profile of 2-oxa-3-deoxy-25-hydroxyvitamin D3
Property Insights of 2-oxa-3-deoxy-25-hydroxyvitamin D3
The XLogP value of 5.8 indicates that 2-oxa-3-deoxy-25-hydroxyvitamin D3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-oxa-3-deoxy-25-hydroxyvitamin D3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-oxa-3-deoxy-25-hydroxyvitamin D3 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-oxa-3-deoxy-25-hydroxyvitamin D3?
The CAS number of 2-oxa-3-deoxy-25-hydroxyvitamin D3 is 113490-39-4.
What is the molecular formula of 2-oxa-3-deoxy-25-hydroxyvitamin D3?
The molecular formula of 2-oxa-3-deoxy-25-hydroxyvitamin D3 is C26H42O2.
What is the molecular weight of 2-oxa-3-deoxy-25-hydroxyvitamin D3?
The molecular weight of 2-oxa-3-deoxy-25-hydroxyvitamin D3 is 386.31848 g/mol.
Where can I buy 2-oxa-3-deoxy-25-hydroxyvitamin D3?
You can request a quote for 2-oxa-3-deoxy-25-hydroxyvitamin D3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-oxa-3-deoxy-25-hydroxyvitamin D3?
Yes, CoreyChem provides custom synthesis services for 2-oxa-3-deoxy-25-hydroxyvitamin D3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.