Di-(2hydroxy-2-propyl)benzene
TL;DR: Di-(2hydroxy-2-propyl)benzene (CAS 113710-82-0) 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-[2-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
Also Known As: di-(2hydroxy-2-propyl)benzene, 2,2'-benzene-1,2-diyldipropan-2-ol, 2-[2-(1-hydroxy-1-methylethyl)phenyl]-2-propanol, 2-[2-(2-hydroxypropan-2-yl)phenyl]propan-2-ol, J1.808.839H
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 113710-82-0 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1C(C)(C)O)O |
| InChIKey | KSMBFKMHJGVFQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-(2hydroxy-2-propyl)benzene (CAS 113710-82-0), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 2-[2-(2-hydroxypropan-2-yl)phenyl]propan-2-ol.
Chemical Property Profile of Di-(2hydroxy-2-propyl)benzene
Property Insights of Di-(2hydroxy-2-propyl)benzene
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Di-(2hydroxy-2-propyl)benzene. With a topological polar surface area (TPSA) of 40.5 Ų, Di-(2hydroxy-2-propyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-(2hydroxy-2-propyl)benzene 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 Di-(2hydroxy-2-propyl)benzene?
The CAS number of Di-(2hydroxy-2-propyl)benzene is 113710-82-0.
What is the molecular formula of Di-(2hydroxy-2-propyl)benzene?
The molecular formula of Di-(2hydroxy-2-propyl)benzene is C12H18O2.
What is the molecular weight of Di-(2hydroxy-2-propyl)benzene?
The molecular weight of Di-(2hydroxy-2-propyl)benzene is 194.13 g/mol.
Where can I buy Di-(2hydroxy-2-propyl)benzene?
You can request a quote for Di-(2hydroxy-2-propyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-(2hydroxy-2-propyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for Di-(2hydroxy-2-propyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.