![6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one structure](/static/products/3314/331463-64-0.webp)
6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one
TL;DR: 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one (CAS 331463-64-0) is a chemical compound with molecular formula C15H18O4 and molecular weight 262.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one
Also Known As: ChemDiv2_000896, BAS 00335711, 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one, 6',7'-dimethoxy-1'H-spiro[cyclopentane-1,4'-isochromen]-3'-one, 11,12-dimethoxyspiro[cyclopentane-1,4'-isochromane]-8-one
| Molecular Formula | C15H18O4 |
|---|---|
| Molecular Weight | 262.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.1205 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 331463-64-0 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)COC(=O)C23CCCC3)OC |
| InChIKey | RLMZLXDUBOMHDM-UHFFFAOYSA-N |
Product Overview
6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one (CAS 331463-64-0), with molecular formula C15H18O4 and molecular weight 262.12 g/mol. IUPAC: 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one.
Chemical Property Profile of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one
Property Insights of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one. With a topological polar surface area (TPSA) of 44.8 Ų, 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one has 0 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 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one?
The CAS number of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one is 331463-64-0.
What is the molecular formula of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one?
The molecular formula of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one is C15H18O4.
What is the molecular weight of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one?
The molecular weight of 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one is 262.12 g/mol.
Where can I buy 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one?
You can request a quote for 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxyspiro[1H-isochromene-4,1'-cyclopentane]-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.