1,3-Benzenediol, 2-methyl-5-pentyl-
TL;DR: 1,3-Benzenediol, 2-methyl-5-pentyl- (CAS 56226-07-4) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-pentylbenzene-1,3-diol
Also Known As: 2-Methylolivetol, 1,3-Benzenediol, 2-methyl-5-pentyl-, 2-methyl-5-pentylbenzene-1,3-diol, 2-METHYL-5-PENTYLRESORCINOL, RefChem:217787
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 3.13892 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 282.18518 |
Chemical Identifiers
| CAS Number | 56226-07-4 |
|---|---|
| SMILES | CCCCCC1=CC(=C(C(=C1)O)C)O |
Product Overview
1,3-Benzenediol, 2-methyl-5-pentyl- (CAS 56226-07-4), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 2-methyl-5-pentylbenzene-1,3-diol.
Chemical Property Profile of 1,3-Benzenediol, 2-methyl-5-pentyl-
Property Insights of 1,3-Benzenediol, 2-methyl-5-pentyl-
The XLogP value of 3.13892 indicates that 1,3-Benzenediol, 2-methyl-5-pentyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 1,3-Benzenediol, 2-methyl-5-pentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzenediol, 2-methyl-5-pentyl- 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 1,3-Benzenediol, 2-methyl-5-pentyl-?
The CAS number of 1,3-Benzenediol, 2-methyl-5-pentyl- is 56226-07-4.
What is the molecular formula of 1,3-Benzenediol, 2-methyl-5-pentyl-?
The molecular formula of 1,3-Benzenediol, 2-methyl-5-pentyl- is C12H18O2.
What is the molecular weight of 1,3-Benzenediol, 2-methyl-5-pentyl-?
The molecular weight of 1,3-Benzenediol, 2-methyl-5-pentyl- is 194.13 g/mol.
Where can I buy 1,3-Benzenediol, 2-methyl-5-pentyl-?
You can request a quote for 1,3-Benzenediol, 2-methyl-5-pentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenediol, 2-methyl-5-pentyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenediol, 2-methyl-5-pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.