二乙醇
TL;DR: 二乙醇 (CAS 1143-38-0) is a chemical compound with molecular formula C14H10O3 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙醇
1,8-dihydroxy-10H-anthracen-9-one
Also Known As: anthralin, Dithranol, Cignolin, Chrysodermol, Cigthranol
| Molecular Formula | C14H10O3 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.06299 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
| Melting Point | 349 to 181.1 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 1143-38-0 |
|---|---|
| SMILES | C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O |
| InChIKey | NUZWLKWWNNJHPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二乙醇 (CAS 1143-38-0), with molecular formula C14H10O3 and molecular weight 226.06 g/mol. IUPAC: 1,8-dihydroxy-10H-anthracen-9-one.
Chemical Property Profile of 二乙醇
Property Insights of 二乙醇
The XLogP value of 3.2 indicates that 二乙醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 二乙醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二乙醇 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 二乙醇?
The CAS number of 二乙醇 is 1143-38-0.
What is the molecular formula of 二乙醇?
The molecular formula of 二乙醇 is C14H10O3.
What is the molecular weight of 二乙醇?
The molecular weight of 二乙醇 is 226.06 g/mol.
Where can I buy 二乙醇?
You can request a quote for 二乙醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙醇?
Yes, KEHONG BIO provides custom synthesis services for 二乙醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.