![spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one structure](/static/products/4013/40135-90-8.webp)
spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one
TL;DR: spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one (CAS 40135-90-8) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one
Also Known As: J1.860.927D, spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one, spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohex, 7',8'-Dihydro-2'H,6'H-spiro[cyclohexa-2,5-diene-1,5'-naphtho[2,3-d][1,3]dioxol]-4-one, 2',6',7',8'-tetrahydrospiro[cyclohexane-1,5'-naphtho[2,3-d][1,3]dioxole]-2,5-dien-4-one
| Molecular Formula | C16H14O3 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 254.0943 |
| Heavy Atoms | 19 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 40135-90-8 |
|---|---|
| SMILES | C1CC2=CC3=C(C=C2C4(C1)C=CC(=O)C=C4)OCO3 |
| InChIKey | CLIQZJYEUQLIOJ-UHFFFAOYSA-N |
Product Overview
spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one (CAS 40135-90-8), with molecular formula C16H14O3 and molecular weight 254.09 g/mol. IUPAC: spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one.
Chemical Property Profile of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one
Property Insights of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one
The XLogP value of 3.5 indicates that spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one has 0 hydrogen bond donor(s) and 3 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 spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one?
The CAS number of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one is 40135-90-8.
What is the molecular formula of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one?
The molecular formula of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one is C16H14O3.
What is the molecular weight of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one?
The molecular weight of spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one is 254.09 g/mol.
Where can I buy spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one?
You can request a quote for spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one?
Yes, KEHONG BIO provides custom synthesis services for spiro[7,8-dihydro-6H-benzo[f][1,3]benzodioxole-5,4'-cyclohexa-2,5-diene]-1'-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.