![Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- structure](/static/products/125/125452-19-9.png)
Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-
TL;DR: Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- (CAS 125452-19-9) is a chemical compound with molecular formula C12H11BO2 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,4-dioxa-3-boratricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene
Also Known As: 2-Ethylnaphtho{1,8-de}-1,3,2-dioxaborinin, Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-, 2-Ethylnaphtho[1,8-de][1,3,2]dioxaborinine #
| Molecular Formula | C12H11BO2 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 3.1191 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.0852 |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 125452-19-9 |
|---|---|
| SMILES | B1(OC2=CC=CC3=C2C(=CC=C3)O1)CC |
| InChIKey | UWPZHNDFVDXYCV-UHFFFAOYSA-N |
Product Overview
Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- (CAS 125452-19-9), with molecular formula C12H11BO2 and molecular weight 198.09 g/mol. IUPAC: 3-ethyl-2,4-dioxa-3-boratricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene.
Chemical Property Profile of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-
Property Insights of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-
The XLogP value of 3.1191 indicates that Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- has 0 hydrogen bond donor(s) and 2 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 Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-?
The CAS number of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- is 125452-19-9.
What is the molecular formula of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-?
The molecular formula of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- is C12H11BO2.
What is the molecular weight of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-?
The molecular weight of Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- is 198.09 g/mol.
Where can I buy Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-?
You can request a quote for Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[1,8-de]-1,3,2-dioxaborin, 2-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.