5-(Dimethylamino)-1,3-benzenediol
TL;DR: 5-(Dimethylamino)-1,3-benzenediol (CAS 40248-00-8) is a chemical compound with molecular formula C8H11NO2 and molecular weight 153.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)benzene-1,3-diol
Also Known As: 5-(Dimethylamino)-1,3-benzenediol, 5-(dimethylamino)benzene-1,3-diol, 5-Dimethylamino-benzene-1,3-diol, 3,5-dihydroxy-N,N-dimethylaniline, 1,3-Benzenediol, 5-(dimethylamino)-
| Molecular Formula | C8H11NO2 |
|---|---|
| Molecular Weight | 153.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 153.07898 |
| Heavy Atoms | 11 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 40248-00-8 |
|---|---|
| SMILES | CN(C)C1=CC(=CC(=C1)O)O |
| InChIKey | UPCBSLSRFRFVDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Dimethylamino)-1,3-benzenediol (CAS 40248-00-8), with molecular formula C8H11NO2 and molecular weight 153.08 g/mol. IUPAC: 5-(dimethylamino)benzene-1,3-diol.
Chemical Property Profile of 5-(Dimethylamino)-1,3-benzenediol
Property Insights of 5-(Dimethylamino)-1,3-benzenediol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Dimethylamino)-1,3-benzenediol. With a topological polar surface area (TPSA) of 43.7 Ų, 5-(Dimethylamino)-1,3-benzenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-1,3-benzenediol has 2 hydrogen bond donor(s) and 3 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 5-(Dimethylamino)-1,3-benzenediol?
The CAS number of 5-(Dimethylamino)-1,3-benzenediol is 40248-00-8.
What is the molecular formula of 5-(Dimethylamino)-1,3-benzenediol?
The molecular formula of 5-(Dimethylamino)-1,3-benzenediol is C8H11NO2.
What is the molecular weight of 5-(Dimethylamino)-1,3-benzenediol?
The molecular weight of 5-(Dimethylamino)-1,3-benzenediol is 153.08 g/mol.
Where can I buy 5-(Dimethylamino)-1,3-benzenediol?
You can request a quote for 5-(Dimethylamino)-1,3-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-1,3-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-1,3-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.