3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone
TL;DR: 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone (CAS 59677-77-9) is a chemical compound with molecular formula C18H16O6 and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dihydroxy-3-[(Z)-3-hydroxy-3-phenylprop-2-enoyl]-6-methoxy-5-methylbenzaldehyde
Also Known As: J2.016.706H, 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone, 3'-Formyl-2',6',b-trihydroxy-4'-methoxy-5'-methylchalcone, 3'-Formyl-2',6',I2-trihydroxy-4'-methoxy-5'-methylchalcone, 2,4-Dihydroxy-3-(beta-hydroxy-trans-cinnamoyl)-5-methyl-6-methoxybenzaldehyde
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 3.00912 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 821.3929 |
Chemical Identifiers
| CAS Number | 59677-77-9 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1OC)C=O)O)C(=O)/C=C(/C2=CC=CC=C2)\O)O |
Product Overview
3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone (CAS 59677-77-9), with molecular formula C18H16O6 and molecular weight 328.09 g/mol. IUPAC: 2,4-dihydroxy-3-[(Z)-3-hydroxy-3-phenylprop-2-enoyl]-6-methoxy-5-methylbenzaldehyde.
Chemical Property Profile of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone
Property Insights of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone
The XLogP value of 3.00912 indicates that 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone. Following Lipinski's Rule of Five, 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone has 3 hydrogen bond donor(s) and 6 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'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone?
The CAS number of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone is 59677-77-9.
What is the molecular formula of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone?
The molecular formula of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone is C18H16O6.
What is the molecular weight of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone?
The molecular weight of 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone is 328.09 g/mol.
Where can I buy 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone?
You can request a quote for 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone?
Yes, KEHONG BIO provides custom synthesis services for 3'-Formyl-2',6',beta-trihydroxy-4'-methoxy-5'-methylchalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.