甲基对苯二酚
TL;DR: 甲基对苯二酚 (CAS 95-71-6) is a chemical compound with molecular formula C7H8O2 and molecular weight 124.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基对苯二酚
2-methylbenzene-1,4-diol
Also Known As: Methylhydroquinone, 2-Methylhydroquinone, 2-methylbenzene-1,4-diol, 2,5-Dihydroxytoluene, Toluhydroquinone
| Molecular Formula | C7H8O2 |
|---|---|
| Molecular Weight | 124.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.05243 |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
| Vapor Pressure | 0.0028 [mmHg] |
Chemical Identifiers
| CAS Number | 95-71-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)O)O |
| InChIKey | CNHDIAIOKMXOLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基对苯二酚 (CAS 95-71-6), with molecular formula C7H8O2 and molecular weight 124.05 g/mol. IUPAC: 2-methylbenzene-1,4-diol.
Chemical Property Profile of 甲基对苯二酚
Property Insights of 甲基对苯二酚
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基对苯二酚. With a topological polar surface area (TPSA) of 40.5 Ų, 甲基对苯二酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基对苯二酚 has 2 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 甲基对苯二酚?
The CAS number of 甲基对苯二酚 is 95-71-6.
What is the molecular formula of 甲基对苯二酚?
The molecular formula of 甲基对苯二酚 is C7H8O2.
What is the molecular weight of 甲基对苯二酚?
The molecular weight of 甲基对苯二酚 is 124.05 g/mol.
Where can I buy 甲基对苯二酚?
You can request a quote for 甲基对苯二酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基对苯二酚?
Yes, KEHONG BIO provides custom synthesis services for 甲基对苯二酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.