25-hydroxyvitamin D3
TL;DR: 25-hydroxyvitamin D3 (CAS 36149-00-5) is a chemical compound with molecular formula C27H44O2 and molecular weight 400.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-[(2Z)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
Also Known As: 25-hydroxyvitamin D3, 5,6-trans-25-Hydroxyvitamin D3, 25-Hydroxy-5,6-trans-vitamin D3, EINECS 252-891-2, 5,6-trans-25-Hydroxycholecalciferol
| Molecular Formula | C27H44O2 |
|---|---|
| Molecular Weight | 400.33 g/mol |
| LogP | 6.7339 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.33414 |
| Heavy Atoms | 29 |
| Complexity | 649.93915 |
Chemical Identifiers
| CAS Number | 36149-00-5 |
|---|---|
| SMILES | CC(CCCC(C)(C)O)C1CCC\2C1(CCC/C2=C/C=C/3\CC(CCC3=C)O)C |
Product Overview
25-hydroxyvitamin D3 (CAS 36149-00-5), with molecular formula C27H44O2 and molecular weight 400.33 g/mol. IUPAC: (3E)-3-[(2Z)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol.
Chemical Property Profile of 25-hydroxyvitamin D3
Property Insights of 25-hydroxyvitamin D3
The XLogP value of 6.7339 indicates that 25-hydroxyvitamin D3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 25-hydroxyvitamin D3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 25-hydroxyvitamin D3 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 25-hydroxyvitamin D3?
The CAS number of 25-hydroxyvitamin D3 is 36149-00-5.
What is the molecular formula of 25-hydroxyvitamin D3?
The molecular formula of 25-hydroxyvitamin D3 is C27H44O2.
What is the molecular weight of 25-hydroxyvitamin D3?
The molecular weight of 25-hydroxyvitamin D3 is 400.33 g/mol.
Where can I buy 25-hydroxyvitamin D3?
You can request a quote for 25-hydroxyvitamin D3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 25-hydroxyvitamin D3?
Yes, KEHONG BIO provides custom synthesis services for 25-hydroxyvitamin D3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.