![6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one structure](/static/products/128/128409-22-3.png)
6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one
TL;DR: 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one (CAS 128409-22-3) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-2-propyl-5,7-dihydro-1,3-benzoxazol-4-one
Also Known As: IDI1_006865, 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one, 6,6-dimethyl-2-propyl-5,7-dihydro-1,3-benzoxazol-4-one, 6,6-dimethyl-2-propyl-6,7-dihydro-1,3-benzoxazol-4(5H)-one, Cambridge id 5220174
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 2.7822 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 390.32642 |
Chemical Identifiers
| CAS Number | 128409-22-3 |
|---|---|
| SMILES | CCCC1=NC2=C(O1)CC(CC2=O)(C)C |
Product Overview
6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one (CAS 128409-22-3), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 6,6-dimethyl-2-propyl-5,7-dihydro-1,3-benzoxazol-4-one.
Chemical Property Profile of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one
Property Insights of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one
The XLogP value of 2.7822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one. With a topological polar surface area (TPSA) of 43.1 Ų, 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one has 0 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 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one?
The CAS number of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one is 128409-22-3.
What is the molecular formula of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one?
The molecular formula of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one is C12H17NO2.
What is the molecular weight of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one?
The molecular weight of 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one is 207.13 g/mol.
Where can I buy 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one?
You can request a quote for 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6,6-dimethyl-2-propyl-6,7-dihydrobenzo[d]oxazol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.