4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime
TL;DR: 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime (CAS 535935-39-8) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydrochromen-4-ylidene)hydroxylamine
Also Known As: CHROMAN-4-ONE OXIME, 4-chromanone oxime, Chroman-4-one, Chroman-4-oneoxime, 4-hydroxyiminochroman
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 1.6474 |
| Topological Polar Surface Area | 41.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 320.0595 |
Chemical Identifiers
| CAS Number | 535935-39-8 |
|---|---|
| SMILES | C1COC2=CC=CC=C2C1=NO |
Product Overview
4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime (CAS 535935-39-8), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: N-(2,3-dihydrochromen-4-ylidene)hydroxylamine.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime
Property Insights of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime
The XLogP value of 1.6474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime. With a topological polar surface area (TPSA) of 41.82 Ų, 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime has 1 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 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime?
The CAS number of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime is 535935-39-8.
What is the molecular formula of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime?
The molecular formula of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime is C9H9NO2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime?
The molecular weight of 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime is 163.06 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime?
You can request a quote for 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 2,3-dihydro-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.