Dianin化合物
TL;DR: Dianin化合物 (CAS 472-41-3) is a chemical compound with molecular formula C18H20O2 and molecular weight 268.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Dianin化合物
4-(2,2,4-trimethyl-3H-chromen-4-yl)phenol
Also Known As: Dianin's compound, 4-(2,2,4-trimethylchroman-4-yl)phenol, Chroman I, codimer, Diamin's compound
| Molecular Formula | C18H20O2 |
|---|---|
| Molecular Weight | 268.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.14633 |
| Heavy Atoms | 20 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 472-41-3 |
|---|---|
| SMILES | CC1(CC(C2=CC=CC=C2O1)(C)C3=CC=C(C=C3)O)C |
| InChIKey | KXYDGGNWZUHESZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dianin化合物 (CAS 472-41-3), with molecular formula C18H20O2 and molecular weight 268.15 g/mol. IUPAC: 4-(2,2,4-trimethyl-3H-chromen-4-yl)phenol.
Chemical Property Profile of Dianin化合物
Property Insights of Dianin化合物
The XLogP value of 4.5 indicates that Dianin化合物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Dianin化合物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dianin化合物 has 1 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 Dianin化合物?
The CAS number of Dianin化合物 is 472-41-3.
What is the molecular formula of Dianin化合物?
The molecular formula of Dianin化合物 is C18H20O2.
What is the molecular weight of Dianin化合物?
The molecular weight of Dianin化合物 is 268.15 g/mol.
Where can I buy Dianin化合物?
You can request a quote for Dianin化合物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dianin化合物?
Yes, KEHONG BIO provides custom synthesis services for Dianin化合物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.