1,4-Benzenediol, bis(1-methyltridecyl)-
TL;DR: 1,4-Benzenediol, bis(1-methyltridecyl)- (CAS 63451-52-5) is a chemical compound with molecular formula C34H62O2 and molecular weight 502.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-di(tetradecan-2-yl)benzene-1,4-diol
Also Known As: Bis(1-methyltridecyl)hydroquinone, 1,4-Benzenediol, bis(1-methyltridecyl)-, 2,5-di(tetradecan-2-yl)benzene-1,4-diol, 1,4-Benzenediol, 2,5-di-sec-tetradecyl-, EINECS 264-204-3
| Molecular Formula | C34H62O2 |
|---|---|
| Molecular Weight | 502.47 g/mol |
| LogP | 15.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 24 |
| Exact Mass | 502.47498 |
| Heavy Atoms | 36 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 63451-52-5 |
|---|---|
| SMILES | CCCCCCCCCCCCC(C)C1=CC(=C(C=C1O)C(C)CCCCCCCCCCCC)O |
| InChIKey | BRBROBKGYBWGSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzenediol, bis(1-methyltridecyl)- (CAS 63451-52-5), with molecular formula C34H62O2 and molecular weight 502.47 g/mol. IUPAC: 2,5-di(tetradecan-2-yl)benzene-1,4-diol.
Chemical Property Profile of 1,4-Benzenediol, bis(1-methyltridecyl)-
Property Insights of 1,4-Benzenediol, bis(1-methyltridecyl)-
The XLogP value of 15.4 indicates that 1,4-Benzenediol, bis(1-methyltridecyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1,4-Benzenediol, bis(1-methyltridecyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediol, bis(1-methyltridecyl)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Benzenediol, bis(1-methyltridecyl)-?
The CAS number of 1,4-Benzenediol, bis(1-methyltridecyl)- is 63451-52-5.
What is the molecular formula of 1,4-Benzenediol, bis(1-methyltridecyl)-?
The molecular formula of 1,4-Benzenediol, bis(1-methyltridecyl)- is C34H62O2.
What is the molecular weight of 1,4-Benzenediol, bis(1-methyltridecyl)-?
The molecular weight of 1,4-Benzenediol, bis(1-methyltridecyl)- is 502.47 g/mol.
Where can I buy 1,4-Benzenediol, bis(1-methyltridecyl)-?
You can request a quote for 1,4-Benzenediol, bis(1-methyltridecyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzenediol, bis(1-methyltridecyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzenediol, bis(1-methyltridecyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.