Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-
TL;DR: Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- (CAS 99765-53-4) is a chemical compound with molecular formula C18H26O3 and molecular weight 290.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptan-2-yl)oxymethyl]phenyl]methanol
Also Known As: Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-, [2-({[1-methyl-4-(propan-2-yl)-7-oxabicyclo[2.2.1]hept-2-yl]oxy}methyl)phenyl]methanol, [2-({[1-Methyl-4-(propan-2-yl)-7-oxabicyclo[2.2.1]heptan-2-yl]oxy}methyl)phenyl]methanol, [2-[(1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptan-2-yl)oxymethyl]phenyl]methanol, [2-[(4-methyl-1-propan-2-yl-7-oxabicyclo[2.2.1]hept-5-yl)oxymethyl]phenyl]methanol
| Molecular Formula | C18H26O3 |
|---|---|
| Molecular Weight | 290.19 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.1882 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 99765-53-4 |
|---|---|
| SMILES | CC(C)C12CCC(O1)(C(C2)OCC3=CC=CC=C3CO)C |
| InChIKey | HFGXZRUMXKJEIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- (CAS 99765-53-4), with molecular formula C18H26O3 and molecular weight 290.19 g/mol. IUPAC: [2-[(1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptan-2-yl)oxymethyl]phenyl]methanol.
Chemical Property Profile of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-
Property Insights of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-. With a topological polar surface area (TPSA) of 38.7 Ų, Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- has 1 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 Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-?
The CAS number of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- is 99765-53-4.
What is the molecular formula of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-?
The molecular formula of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- is C18H26O3.
What is the molecular weight of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-?
The molecular weight of Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- is 290.19 g/mol.
Where can I buy Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-?
You can request a quote for Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, 2-(((1-methyl-4-(1-methylethyl)-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, exo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.