Vitamin D6
TL;DR: Vitamin D6 (CAS 874187-07-2) is a chemical compound with molecular formula C29H46O and molecular weight 410.35 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-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
Also Known As: Vitamin D6, (22E)-(24R)-Ethyl-22,23-didehydrocalciol, Ethyl-22,23-didehydrocalciol, (22E)-(24R)-, (5Z,7E,22E)-(3S)-9,10-seco-5,7,10(19),22-poriferastatetraen-3-ol, (5Z,7E,22E)-(3S,24R)-24-ethyl-9,10-seco-5,7,10(19),22-cholestatetraen-3-ol
| Molecular Formula | C29H46O |
|---|---|
| Molecular Weight | 410.35 g/mol |
| LogP | 8.0311 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.35486 |
| Heavy Atoms | 30 |
| Complexity | 693.15216 |
Chemical Identifiers
| CAS Number | 874187-07-2 |
|---|---|
| SMILES | CC[C@@H](/C=C/[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 D6 (CAS 874187-07-2), with molecular formula C29H46O and molecular weight 410.35 g/mol. IUPAC: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-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 D6
Property Insights of Vitamin D6
The XLogP value of 8.0311 indicates that Vitamin D6 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 D6 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vitamin D6 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 D6?
The CAS number of Vitamin D6 is 874187-07-2.
What is the molecular formula of Vitamin D6?
The molecular formula of Vitamin D6 is C29H46O.
What is the molecular weight of Vitamin D6?
The molecular weight of Vitamin D6 is 410.35 g/mol.
Where can I buy Vitamin D6?
You can request a quote for Vitamin D6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vitamin D6?
Yes, KEHONG BIO provides custom synthesis services for Vitamin D6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.