2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one
TL;DR: 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS 14713-89-4) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5,6,7,8-tetrahydrochromen-4-one
Also Known As: 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one, 2-METHYL-5,6,7,8-TETRAHYDROCHROMONE, 2-Methyl-5,6,7,8-tetrahydro-4-chromenone, 2-methyl-5,6,7,8-tetrahydrochromen-4-one, J1.400.447E
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 14713-89-4 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(O1)CCCC2 |
| InChIKey | YZYTUKCUCAZYHF-UHFFFAOYSA-N |
Product Overview
2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one (CAS 14713-89-4), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 2-methyl-5,6,7,8-tetrahydrochromen-4-one.
Chemical Property Profile of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one
Property Insights of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one 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 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one?
The CAS number of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one is 14713-89-4.
What is the molecular formula of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one?
The molecular formula of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one is C10H12O2.
What is the molecular weight of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one?
The molecular weight of 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one is 164.08 g/mol.
Where can I buy 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one?
You can request a quote for 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5,6,7,8-tetrahydro-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.