25-Hydroxycholecalciferol, 5-trans-
TL;DR: 25-Hydroxycholecalciferol, 5-trans- (CAS 1233749-00-2) is a chemical compound with molecular formula C27H44O2 and molecular weight 400.33414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,3E)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-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: Calcifediol, Calcidiol, Calcifediolum, Calcifidiol, Hidroferol
Technical Specifications
| Molecular Formula | C27H44O2 |
| Molecular Weight | 400.33414 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.33414 Da |
| Heavy Atoms | 29 |
| Complexity | 655.0 |
| SMILES | C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C\3/C[C@H](CCC3=C)O)C |
| InChIKey | JWUBBDSIWDLEOM-WIFPIRAHSA-N |
Chemical Property Profile of 25-Hydroxycholecalciferol, 5-trans-
Property Insights of 25-Hydroxycholecalciferol, 5-trans-
The XLogP value of 6.2 indicates that 25-Hydroxycholecalciferol, 5-trans- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 25-Hydroxycholecalciferol, 5-trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 25-Hydroxycholecalciferol, 5-trans- has 2 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 25-Hydroxycholecalciferol, 5-trans-?
The CAS number of 25-Hydroxycholecalciferol, 5-trans- is 1233749-00-2.
What is the molecular formula of 25-Hydroxycholecalciferol, 5-trans-?
The molecular formula of 25-Hydroxycholecalciferol, 5-trans- is C27H44O2.
What is the molecular weight of 25-Hydroxycholecalciferol, 5-trans-?
The molecular weight of 25-Hydroxycholecalciferol, 5-trans- is 400.33414 g/mol.
Where can I buy 25-Hydroxycholecalciferol, 5-trans-?
You can request a quote for 25-Hydroxycholecalciferol, 5-trans- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 25-Hydroxycholecalciferol, 5-trans-?
Yes, CoreyChem provides custom synthesis services for 25-Hydroxycholecalciferol, 5-trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.