6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-
TL;DR: 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- (CAS 55255-96-4) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(hydroxymethyl)-4-methyl-6-oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one
Also Known As: Pyridoxic acid .gamma.-lactone, Furo[3,4-c]pyridin-3(1H)-one, 7-hydroxy-6-methyl-, 4-methyl-8-6-oxa-3-azabicyclo[3.2.1]octa-1 ,2,4-triene-7-one, 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-, 8-(hydroxymethyl)-4-methyl-6-oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one
| Molecular Formula | C8H7NO3 |
|---|---|
| Molecular Weight | 165.04 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.04259 |
| Heavy Atoms | 12 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 55255-96-4 |
|---|---|
| SMILES | CC1=NC=C2C(=C1OC2=O)CO |
| InChIKey | UIDBDSROYHBCGC-UHFFFAOYSA-N |
Product Overview
6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- (CAS 55255-96-4), with molecular formula C8H7NO3 and molecular weight 165.04 g/mol. IUPAC: 8-(hydroxymethyl)-4-methyl-6-oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one.
Chemical Property Profile of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-
Property Insights of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-
The XLogP value of -0.1 indicates that 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.4 Ų, 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- has 1 hydrogen bond donor(s) and 4 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-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-?
The CAS number of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- is 55255-96-4.
What is the molecular formula of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-?
The molecular formula of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- is C8H7NO3.
What is the molecular weight of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-?
The molecular weight of 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- is 165.04 g/mol.
Where can I buy 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-?
You can request a quote for 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 6-Oxa-3-azabicyclo[3.2.1]octa-1,3,5(8)-trien-7-one, 8-(hydroxymethyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.