Octane, 2,2,7,7-tetramethyl-
TL;DR: Octane, 2,2,7,7-tetramethyl- (CAS 1071-31-4) is a chemical compound with molecular formula C12H26 and molecular weight 170.20345 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,7,7-tetramethyloctane
Also Known As: 2,2,7,7-Tetramethyloctane, Octane, 2,2,7,7-tetramethyl-, Octane,2,2,7,7-tetramethyl-, octane,2,2,7,7-tetramethyl, C12-H26
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H26 |
| Molecular Weight | 170.20345 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 170.20345 Da |
| Heavy Atoms | 12 |
| Complexity | 93.0 |
| SMILES | CC(C)(C)CCCCC(C)(C)C |
| InChIKey | QZUFNKONEPLWBC-UHFFFAOYSA-N |
Chemical Property Profile of Octane, 2,2,7,7-tetramethyl-
Property Insights of Octane, 2,2,7,7-tetramethyl-
The XLogP value of 5.8 indicates that Octane, 2,2,7,7-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Octane, 2,2,7,7-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octane, 2,2,7,7-tetramethyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Octane, 2,2,7,7-tetramethyl-?
The CAS number of Octane, 2,2,7,7-tetramethyl- is 1071-31-4.
What is the molecular formula of Octane, 2,2,7,7-tetramethyl-?
The molecular formula of Octane, 2,2,7,7-tetramethyl- is C12H26.
What is the molecular weight of Octane, 2,2,7,7-tetramethyl-?
The molecular weight of Octane, 2,2,7,7-tetramethyl- is 170.20345 g/mol.
Where can I buy Octane, 2,2,7,7-tetramethyl-?
You can request a quote for Octane, 2,2,7,7-tetramethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Octane, 2,2,7,7-tetramethyl-?
Yes, CoreyChem provides custom synthesis services for Octane, 2,2,7,7-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.