Vitamin D5
TL;DR: Vitamin D5 (CAS 71761-06-3) is a chemical compound with molecular formula C29H48O and molecular weight 412.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-ethyl-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: Vitamin D5, 24R-methylcalciol, sitocalciferol, SITOCALCIFEROL [WHO-DD], (5Z,7E)-9,10-Secostigmasta-5,7,10(19)-trien-3beta-ol
| Molecular Formula | C29H48O |
|---|---|
| Molecular Weight | 412.37 g/mol |
| LogP | 8.2551 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 412.3705 |
| Heavy Atoms | 30 |
| Complexity | 653.2747 |
Chemical Identifiers
| CAS Number | 71761-06-3 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C)C(C)C |
Product Overview
Vitamin D5 (CAS 71761-06-3), with molecular formula C29H48O and molecular weight 412.37 g/mol. IUPAC: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-ethyl-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 Vitamin D5
Property Insights of Vitamin D5
The XLogP value of 8.2551 indicates that Vitamin D5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, Vitamin D5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vitamin D5 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Vitamin D5?
The CAS number of Vitamin D5 is 71761-06-3.
What is the molecular formula of Vitamin D5?
The molecular formula of Vitamin D5 is C29H48O.
What is the molecular weight of Vitamin D5?
The molecular weight of Vitamin D5 is 412.37 g/mol.
Where can I buy Vitamin D5?
You can request a quote for Vitamin D5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vitamin D5?
Yes, KEHONG BIO provides custom synthesis services for Vitamin D5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.