3H-2-Benzopyran-3-imine, 1,4-dihydro-
TL;DR: 3H-2-Benzopyran-3-imine, 1,4-dihydro- (CAS 38866-67-0) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroisochromen-3-imine
Also Known As: 1,4-dihydroisochromen-3-imine, 3,4-Dihydro-1H-2-benzopyran-3-imine, 1,4-Dihydro-3H-isochromen-3-imine, 3H-2-Benzopyran-3-imine, 1,4-dihydro-, 1,4-Dihydro-3H-isochromen-3-imine #
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 38866-67-0 |
|---|---|
| SMILES | C1C2=CC=CC=C2COC1=N |
| InChIKey | YKSYXURMRBAVKT-UHFFFAOYSA-N |
Product Overview
3H-2-Benzopyran-3-imine, 1,4-dihydro- (CAS 38866-67-0), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: 1,4-dihydroisochromen-3-imine.
Chemical Property Profile of 3H-2-Benzopyran-3-imine, 1,4-dihydro-
Property Insights of 3H-2-Benzopyran-3-imine, 1,4-dihydro-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-2-Benzopyran-3-imine, 1,4-dihydro-. With a topological polar surface area (TPSA) of 33.1 Ų, 3H-2-Benzopyran-3-imine, 1,4-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-2-Benzopyran-3-imine, 1,4-dihydro- has 1 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 3H-2-Benzopyran-3-imine, 1,4-dihydro-?
The CAS number of 3H-2-Benzopyran-3-imine, 1,4-dihydro- is 38866-67-0.
What is the molecular formula of 3H-2-Benzopyran-3-imine, 1,4-dihydro-?
The molecular formula of 3H-2-Benzopyran-3-imine, 1,4-dihydro- is C9H9NO.
What is the molecular weight of 3H-2-Benzopyran-3-imine, 1,4-dihydro-?
The molecular weight of 3H-2-Benzopyran-3-imine, 1,4-dihydro- is 147.07 g/mol.
Where can I buy 3H-2-Benzopyran-3-imine, 1,4-dihydro-?
You can request a quote for 3H-2-Benzopyran-3-imine, 1,4-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-2-Benzopyran-3-imine, 1,4-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 3H-2-Benzopyran-3-imine, 1,4-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.