Oxazole, 5-isobutyl-4-methyl-
TL;DR: Oxazole, 5-isobutyl-4-methyl- (CAS 29584-95-0) is a chemical compound with molecular formula C8H13NO and molecular weight 139.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-(2-methylpropyl)-1,3-oxazole
Also Known As: 5-Isobutyl-4-methyloxazole, Oxazole, 5-isobutyl-4-methyl-, 4-methyl-5-(2-methylpropyl)-1,3-oxazole, BRN 0971052, RefChem:367264
| Molecular Formula | C8H13NO |
|---|---|
| Molecular Weight | 139.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.09972 |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 29584-95-0 |
|---|---|
| SMILES | CC1=C(OC=N1)CC(C)C |
| InChIKey | KICZSSGEFMLGPN-UHFFFAOYSA-N |
Product Overview
Oxazole, 5-isobutyl-4-methyl- (CAS 29584-95-0), with molecular formula C8H13NO and molecular weight 139.10 g/mol. IUPAC: 4-methyl-5-(2-methylpropyl)-1,3-oxazole.
Chemical Property Profile of Oxazole, 5-isobutyl-4-methyl-
Property Insights of Oxazole, 5-isobutyl-4-methyl-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxazole, 5-isobutyl-4-methyl-. With a topological polar surface area (TPSA) of 26.0 Ų, Oxazole, 5-isobutyl-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazole, 5-isobutyl-4-methyl- 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 Oxazole, 5-isobutyl-4-methyl-?
The CAS number of Oxazole, 5-isobutyl-4-methyl- is 29584-95-0.
What is the molecular formula of Oxazole, 5-isobutyl-4-methyl-?
The molecular formula of Oxazole, 5-isobutyl-4-methyl- is C8H13NO.
What is the molecular weight of Oxazole, 5-isobutyl-4-methyl-?
The molecular weight of Oxazole, 5-isobutyl-4-methyl- is 139.10 g/mol.
Where can I buy Oxazole, 5-isobutyl-4-methyl-?
You can request a quote for Oxazole, 5-isobutyl-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxazole, 5-isobutyl-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Oxazole, 5-isobutyl-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.