ChemDiv1_001308
TL;DR: ChemDiv1_001308 (CAS 328266-29-1) is a chemical compound with molecular formula C30H30ClFO4 and molecular weight 508.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
Also Known As: ChemDiv1_001308, BAS 00770551, 9-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, 9-(4-((2-chloro-6-fluorobenzyl)oxy)phenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, 9-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
| Molecular Formula | C30H30ClFO4 |
|---|---|
| Molecular Weight | 508.18 g/mol |
| LogP | 7.4583 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.18167 |
| Heavy Atoms | 36 |
| Complexity | 1244.7092 |
Chemical Identifiers
| CAS Number | 328266-29-1 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=C(C=C4)OCC5=C(C=CC=C5Cl)F)C(=O)C1)C |
Product Overview
ChemDiv1_001308 (CAS 328266-29-1), with molecular formula C30H30ClFO4 and molecular weight 508.18 g/mol. IUPAC: 9-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione.
Chemical Property Profile of ChemDiv1_001308
Property Insights of ChemDiv1_001308
The XLogP value of 7.4583 indicates that ChemDiv1_001308 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, ChemDiv1_001308 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_001308 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 ChemDiv1_001308?
The CAS number of ChemDiv1_001308 is 328266-29-1.
What is the molecular formula of ChemDiv1_001308?
The molecular formula of ChemDiv1_001308 is C30H30ClFO4.
What is the molecular weight of ChemDiv1_001308?
The molecular weight of ChemDiv1_001308 is 508.18 g/mol.
Where can I buy ChemDiv1_001308?
You can request a quote for ChemDiv1_001308 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001308?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001308 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.