2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride
TL;DR: 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride (CAS 45115-53-5) is a chemical compound with molecular formula C12H18ClNO and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-phenylmorpholine;hydrochloride
Also Known As: 5,5-dimethyl-2-phenylmorpholine hydrochloride, 5,5-Dimethyl-2-phenylmorpholine HCl, Phenyl dimethyltetrahydrooxazine, 2-Phenyl-5,5-dimethylmorpholine hydrochloride, 5,5-dimethyl-2-phenylmorpholine;hydrochloride
| Molecular Formula | C12H18ClNO |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 2.5479 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.1077 |
| Heavy Atoms | 15 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 45115-53-5 |
|---|---|
| SMILES | CC1(COC(CN1)C2=CC=CC=C2)C.Cl |
| InChIKey | ITCSSRXQXNXMCG-UHFFFAOYSA-N |
Product Overview
2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride (CAS 45115-53-5), with molecular formula C12H18ClNO and molecular weight 227.11 g/mol. IUPAC: 5,5-dimethyl-2-phenylmorpholine;hydrochloride.
Chemical Property Profile of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride
Property Insights of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride
The XLogP value of 2.5479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride. With a topological polar surface area (TPSA) of 21.3 Ų, 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride has 2 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 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride?
The CAS number of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride is 45115-53-5.
What is the molecular formula of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride?
The molecular formula of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride is C12H18ClNO.
What is the molecular weight of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride?
The molecular weight of 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride is 227.11 g/mol.
Where can I buy 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride?
You can request a quote for 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-5,5-dimethyltetrahydro-1,4-oxazine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.