![3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one structure](/static/products/4449/444996-42-3.webp)
3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one
TL;DR: 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one (CAS 444996-42-3) is a chemical compound with molecular formula C22H19BrO4 and molecular weight 426.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one
Also Known As: 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one, 3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one, 3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one, 3-(2-(4-Bromophenyl)-2-oxoethoxy)-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo(b,d)pyran-6-one, 3-[2-(4-BROMOPHENYL)-2-OXOETHOXY]-4-METHYL-6H,7H,8H,9H,10H-CYCLOHEXA[C]CHROMEN-6-ONE
| Molecular Formula | C22H19BrO4 |
|---|---|
| Molecular Weight | 426.05 g/mol |
| LogP | 5.00442 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.04666 |
| Heavy Atoms | 27 |
| Complexity | 1080.1484 |
Chemical Identifiers
| CAS Number | 444996-42-3 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C3=C2CCCC3)OCC(=O)C4=CC=C(C=C4)Br |
Product Overview
3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one (CAS 444996-42-3), with molecular formula C22H19BrO4 and molecular weight 426.05 g/mol. IUPAC: 3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one.
Chemical Property Profile of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one
Property Insights of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one
The XLogP value of 5.00442 indicates that 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one?
The CAS number of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one is 444996-42-3.
What is the molecular formula of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one?
The molecular formula of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one is C22H19BrO4.
What is the molecular weight of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one?
The molecular weight of 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one is 426.05 g/mol.
Where can I buy 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one?
You can request a quote for 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-Bromophenyl)-2-oxoethoxy]-7,8,9,10-tetrahydro-4-methyl-6H-dibenzo[b,d]pyran-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.