3-Benzylchromone
TL;DR: 3-Benzylchromone (CAS 30779-85-2) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylchromen-4-one
Also Known As: 3-Benzylchromone, 3-benzylchromen-4-one, Chromone, 3-benzyl-, Maybridge3_000470, 3-Benzyl-4H-chromen-4-one
| Molecular Formula | C16H12O2 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.08372 |
| Heavy Atoms | 18 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 30779-85-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=COC3=CC=CC=C3C2=O |
| InChIKey | BFJYQLLNETVOKQ-UHFFFAOYSA-N |
Product Overview
3-Benzylchromone (CAS 30779-85-2), with molecular formula C16H12O2 and molecular weight 236.08 g/mol. IUPAC: 3-benzylchromen-4-one.
Chemical Property Profile of 3-Benzylchromone
Property Insights of 3-Benzylchromone
The XLogP value of 3.5 indicates that 3-Benzylchromone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Benzylchromone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzylchromone has 0 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 3-Benzylchromone?
The CAS number of 3-Benzylchromone is 30779-85-2.
What is the molecular formula of 3-Benzylchromone?
The molecular formula of 3-Benzylchromone is C16H12O2.
What is the molecular weight of 3-Benzylchromone?
The molecular weight of 3-Benzylchromone is 236.08 g/mol.
Where can I buy 3-Benzylchromone?
You can request a quote for 3-Benzylchromone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzylchromone?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzylchromone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.