Maxacalcitol Impurity 9
TL;DR: Maxacalcitol Impurity 9 (CAS 103909-73-5) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1S)-1-hydroxyethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Also Known As: Maxacalcitol Impurity 9, (20S)-1alpha,20-dihydroxy-22,23,24,25,26,27-hexanorvitamin D3 / (20S)-1alpha,20-dihydroxy-22,23,24,25,26,27-hexanorcholecalciferol, (5Z,7E)-(1S,3R,20S)-9,10-seco-5,7,10(19)-pregnatriene-1,3,20-triol, (5Z,7E,20S)-9,10-Secopregna-5,7,10(19)-triene-1alpha,3beta,20-triol, (1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1S)-1-hydroxyethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 3.5082 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 559.43115 |
Chemical Identifiers
| CAS Number | 103909-73-5 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C)O |
Product Overview
Maxacalcitol Impurity 9 (CAS 103909-73-5), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: trans-(1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1S)-1-hydroxyethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol.
Chemical Property Profile of Maxacalcitol Impurity 9
Property Insights of Maxacalcitol Impurity 9
The XLogP value of 3.5082 indicates that Maxacalcitol Impurity 9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Maxacalcitol Impurity 9. Following Lipinski's Rule of Five, Maxacalcitol Impurity 9 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Maxacalcitol Impurity 9?
The CAS number of Maxacalcitol Impurity 9 is 103909-73-5.
What is the molecular formula of Maxacalcitol Impurity 9?
The molecular formula of Maxacalcitol Impurity 9 is C21H32O3.
What is the molecular weight of Maxacalcitol Impurity 9?
The molecular weight of Maxacalcitol Impurity 9 is 332.24 g/mol.
Where can I buy Maxacalcitol Impurity 9?
You can request a quote for Maxacalcitol Impurity 9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Maxacalcitol Impurity 9?
Yes, KEHONG BIO provides custom synthesis services for Maxacalcitol Impurity 9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.