1-甲基乙基过氧化氢
TL;DR: 1-甲基乙基过氧化氢 (CAS 3031-75-2) is a chemical compound with molecular formula C3H8O2 and molecular weight 76.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-甲基乙基过氧化氢
2-hydroperoxypropane
Also Known As: Isopropyl hydroperoxide, propane-2-peroxol, Hydroperoxide, 1-methylethyl, 2-hydroperoxypropane, 2-(Hydroperoxy)propane
| Molecular Formula | C3H8O2 |
|---|---|
| Molecular Weight | 76.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 76.05243 |
| Heavy Atoms | 5 |
| Complexity | 18.0 |
Chemical Identifiers
| CAS Number | 3031-75-2 |
|---|---|
| SMILES | CC(C)OO |
| InChIKey | SGJUFIMCHSLMRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-甲基乙基过氧化氢 (CAS 3031-75-2), with molecular formula C3H8O2 and molecular weight 76.05 g/mol. IUPAC: 2-hydroperoxypropane.
Chemical Property Profile of 1-甲基乙基过氧化氢
Property Insights of 1-甲基乙基过氧化氢
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-甲基乙基过氧化氢. With a topological polar surface area (TPSA) of 29.5 Ų, 1-甲基乙基过氧化氢 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-甲基乙基过氧化氢 has 1 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 1-甲基乙基过氧化氢?
The CAS number of 1-甲基乙基过氧化氢 is 3031-75-2.
What is the molecular formula of 1-甲基乙基过氧化氢?
The molecular formula of 1-甲基乙基过氧化氢 is C3H8O2.
What is the molecular weight of 1-甲基乙基过氧化氢?
The molecular weight of 1-甲基乙基过氧化氢 is 76.05 g/mol.
Where can I buy 1-甲基乙基过氧化氢?
You can request a quote for 1-甲基乙基过氧化氢 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-甲基乙基过氧化氢?
Yes, KEHONG BIO provides custom synthesis services for 1-甲基乙基过氧化氢 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.