甲基新戊基醚
TL;DR: 甲基新戊基醚 (CAS 1118-00-9) is a chemical compound with molecular formula CC(C)(C)COC and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基新戊基醚
1-methoxy-2,2-dimethylpropane
Also Known As: Ether, methyl neopentyl, 1-Methoxy-2,2-dimethylpropane, Neopentyl methyl ether, Propane, 1-methoxy-2,2-dimethyl-, Methylneopentyl ether
| Molecular Formula | CC(C)(C)COC |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 42.0 |
Chemical Identifiers
| CAS Number | 1118-00-9 |
|---|---|
| SMILES | CC(C)(C)COC |
| InChIKey | JILHZKWLEAKYRC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基新戊基醚 (CAS 1118-00-9), with molecular formula CC(C)(C)COC and molecular weight 102.10 g/mol. IUPAC: 1-methoxy-2,2-dimethylpropane.
Chemical Property Profile of 甲基新戊基醚
Property Insights of 甲基新戊基醚
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基新戊基醚. With a topological polar surface area (TPSA) of 9.2 Ų, 甲基新戊基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基新戊基醚 has 0 hydrogen bond donor(s) and 1 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 甲基新戊基醚?
The CAS number of 甲基新戊基醚 is 1118-00-9.
What is the molecular formula of 甲基新戊基醚?
The molecular formula of 甲基新戊基醚 is CC(C)(C)COC.
What is the molecular weight of 甲基新戊基醚?
The molecular weight of 甲基新戊基醚 is 102.10 g/mol.
Where can I buy 甲基新戊基醚?
You can request a quote for 甲基新戊基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基新戊基醚?
Yes, KEHONG BIO provides custom synthesis services for 甲基新戊基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.