1-氢过氧化对薄荷烷
TL;DR: 1-氢过氧化对薄荷烷 (CAS 78-58-0) is a chemical compound with molecular formula C10H20O2 and molecular weight 172.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-氢过氧化对薄荷烷
1-hydroperoxy-2-methyl-4-propan-2-ylcyclohexane
Also Known As: 4-Isopropyl-1-methylcyclohexyl hydroperoxide, 2-Methyl-4-(propan-2-yl)cyclohexane-1-peroxol, 2-methyl-4-(propan-2-yl)cyclohexyl hydroperoxide, 2-Methyl-4-isopropylcyclohexyl hydroperoxide, 1-hydroperoxy-2-methyl-4-propan-2-ylcyclohexane
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 78-58-0 |
|---|---|
| SMILES | CC1CC(CCC1OO)C(C)C |
| InChIKey | UYKCNZCGIXKEGY-UHFFFAOYSA-N |
Product Overview
1-氢过氧化对薄荷烷 (CAS 78-58-0), with molecular formula C10H20O2 and molecular weight 172.15 g/mol. IUPAC: 1-hydroperoxy-2-methyl-4-propan-2-ylcyclohexane.
Chemical Property Profile of 1-氢过氧化对薄荷烷
Property Insights of 1-氢过氧化对薄荷烷
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-氢过氧化对薄荷烷. With a topological polar surface area (TPSA) of 29.5 Ų, 1-氢过氧化对薄荷烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-氢过氧化对薄荷烷 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-氢过氧化对薄荷烷?
The CAS number of 1-氢过氧化对薄荷烷 is 78-58-0.
What is the molecular formula of 1-氢过氧化对薄荷烷?
The molecular formula of 1-氢过氧化对薄荷烷 is C10H20O2.
What is the molecular weight of 1-氢过氧化对薄荷烷?
The molecular weight of 1-氢过氧化对薄荷烷 is 172.15 g/mol.
Where can I buy 1-氢过氧化对薄荷烷?
You can request a quote for 1-氢过氧化对薄荷烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-氢过氧化对薄荷烷?
Yes, KEHONG BIO provides custom synthesis services for 1-氢过氧化对薄荷烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.