6-Phenyl-1,3-benzodioxole-5-carbaldehyde
TL;DR: 6-Phenyl-1,3-benzodioxole-5-carbaldehyde (CAS 4432-95-5) is a chemical compound with molecular formula C14H10O3 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenyl-1,3-benzodioxole-5-carbaldehyde
Also Known As: starbld0040607, 6-Phenylpiperonylaldehyde, 6-phenylpiperonyl aldehyde, 6-Phenyl-1,3-benzodioxole-5-carbaldehyde, 2-Phenyl-4,5-methylenedioxybenzaldehyde
| Molecular Formula | C14H10O3 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.06299 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 4432-95-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=O)C3=CC=CC=C3 |
| InChIKey | BKQHZVKIZMLDBW-UHFFFAOYSA-N |
Product Overview
6-Phenyl-1,3-benzodioxole-5-carbaldehyde (CAS 4432-95-5), with molecular formula C14H10O3 and molecular weight 226.06 g/mol. IUPAC: 6-phenyl-1,3-benzodioxole-5-carbaldehyde.
Chemical Property Profile of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde
Property Insights of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenyl-1,3-benzodioxole-5-carbaldehyde. With a topological polar surface area (TPSA) of 35.5 Ų, 6-Phenyl-1,3-benzodioxole-5-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenyl-1,3-benzodioxole-5-carbaldehyde 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 6-Phenyl-1,3-benzodioxole-5-carbaldehyde?
The CAS number of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde is 4432-95-5.
What is the molecular formula of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde?
The molecular formula of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde is C14H10O3.
What is the molecular weight of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde?
The molecular weight of 6-Phenyl-1,3-benzodioxole-5-carbaldehyde is 226.06 g/mol.
Where can I buy 6-Phenyl-1,3-benzodioxole-5-carbaldehyde?
You can request a quote for 6-Phenyl-1,3-benzodioxole-5-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenyl-1,3-benzodioxole-5-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenyl-1,3-benzodioxole-5-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.