氨溴索
TL;DR: 氨溴索 (CAS 82079-83-2) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氨溴索
6,6,9a-trimethyl-1,2,3a,4,5,5a,7,8,9,9b-decahydrobenzo[e][1]benzofuran
Also Known As: Ambrox, 8-Demethylisoambroxide, starbld0007314, (+)-8-Demethylisoambrox, 6,6,9a-Trimethyldodecahydronaphtho[2,1-b]furan
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 82079-83-2 |
|---|---|
| SMILES | CC1(CCCC2(C1CCC3C2CCO3)C)C |
| InChIKey | IPEPBOBQYDJNON-UHFFFAOYSA-N |
Product Overview
氨溴索 (CAS 82079-83-2), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 6,6,9a-trimethyl-1,2,3a,4,5,5a,7,8,9,9b-decahydrobenzo[e][1]benzofuran.
Chemical Property Profile of 氨溴索
Property Insights of 氨溴索
The XLogP value of 4.5 indicates that 氨溴索 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 氨溴索 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氨溴索 has 0 hydrogen bond donor(s) and 1 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 氨溴索?
The CAS number of 氨溴索 is 82079-83-2.
What is the molecular formula of 氨溴索?
The molecular formula of 氨溴索 is C15H26O.
What is the molecular weight of 氨溴索?
The molecular weight of 氨溴索 is 222.20 g/mol.
Where can I buy 氨溴索?
You can request a quote for 氨溴索 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氨溴索?
Yes, KEHONG BIO provides custom synthesis services for 氨溴索 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.