ChemDiv1_019509
TL;DR: ChemDiv1_019509 (CAS 5808-33-3) is a chemical compound with molecular formula C14H22O7 and molecular weight 302.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methyl acetate
Also Known As: ChemDiv1_019509, 6-O-ACETYL-1,2, AB00097804-01, AB00097804-03, F1507-0154
| Molecular Formula | C14H22O7 |
|---|---|
| Molecular Weight | 302.14 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.13657 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 5808-33-3 |
|---|---|
| SMILES | CC(=O)OCC1C2C(C3C(O1)OC(O3)(C)C)OC(O2)(C)C |
| InChIKey | PHWOTSJWWWEKMS-UHFFFAOYSA-N |
Product Overview
ChemDiv1_019509 (CAS 5808-33-3), with molecular formula C14H22O7 and molecular weight 302.14 g/mol. IUPAC: (4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methyl acetate.
Chemical Property Profile of ChemDiv1_019509
Property Insights of ChemDiv1_019509
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_019509. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_019509. Following Lipinski's Rule of Five, ChemDiv1_019509 has 0 hydrogen bond donor(s) and 7 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 ChemDiv1_019509?
The CAS number of ChemDiv1_019509 is 5808-33-3.
What is the molecular formula of ChemDiv1_019509?
The molecular formula of ChemDiv1_019509 is C14H22O7.
What is the molecular weight of ChemDiv1_019509?
The molecular weight of ChemDiv1_019509 is 302.14 g/mol.
Where can I buy ChemDiv1_019509?
You can request a quote for ChemDiv1_019509 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019509?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019509 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.