![1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- structure](/static/products/1331/133146-67-5.webp)
1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-
TL;DR: 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- (CAS 133146-67-5) is a chemical compound with molecular formula C16H18O3S and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(1-benzothiophen-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol
Also Known As: Catharanthin-d3, 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-, 8-(1-benzothiophen-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol, 8-(Benzo[b]thiophen-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol
| Molecular Formula | C16H18O3S |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.09766 |
| Heavy Atoms | 20 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 133146-67-5 |
|---|---|
| SMILES | C1CC2(CCC1(C3=CC4=CC=CC=C4S3)O)OCCO2 |
| InChIKey | JGLQLUZGWDPZLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- (CAS 133146-67-5), with molecular formula C16H18O3S and molecular weight 290.10 g/mol. IUPAC: 8-(1-benzothiophen-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol.
Chemical Property Profile of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-
Property Insights of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-. Following Lipinski's Rule of Five, 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- has 1 hydrogen bond donor(s) and 4 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 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-?
The CAS number of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- is 133146-67-5.
What is the molecular formula of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-?
The molecular formula of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- is C16H18O3S.
What is the molecular weight of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-?
The molecular weight of 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- is 290.10 g/mol.
Where can I buy 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-?
You can request a quote for 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxaspiro[4.5]decan-8-ol, 8-benzo[b]thien-2-yl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.