1,4-Benzodioxan-2-methanol, 6,7-dichloro-
TL;DR: 1,4-Benzodioxan-2-methanol, 6,7-dichloro- (CAS 2164-37-6) is a chemical compound with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methanol
Also Known As: 6,7-Dichloro-1,4-benzodioxan-2-methanol, NCI60_021841, 1,4-BENZODIOXAN-2-METHANOL, 6,7-DICHLORO-, 6,7-Dichloro-1,4-benzodioxane-2-methanol, (6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methanol
| Molecular Formula | C9H8Cl2O3 |
|---|---|
| Molecular Weight | 233.99 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.98505 |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 2164-37-6 |
|---|---|
| SMILES | C1C(OC2=CC(=C(C=C2O1)Cl)Cl)CO |
| InChIKey | YSKZPQPJOWLVSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzodioxan-2-methanol, 6,7-dichloro- (CAS 2164-37-6), with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol. IUPAC: (6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methanol.
Chemical Property Profile of 1,4-Benzodioxan-2-methanol, 6,7-dichloro-
Property Insights of 1,4-Benzodioxan-2-methanol, 6,7-dichloro-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzodioxan-2-methanol, 6,7-dichloro-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,4-Benzodioxan-2-methanol, 6,7-dichloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodioxan-2-methanol, 6,7-dichloro- has 1 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 1,4-Benzodioxan-2-methanol, 6,7-dichloro-?
The CAS number of 1,4-Benzodioxan-2-methanol, 6,7-dichloro- is 2164-37-6.
What is the molecular formula of 1,4-Benzodioxan-2-methanol, 6,7-dichloro-?
The molecular formula of 1,4-Benzodioxan-2-methanol, 6,7-dichloro- is C9H8Cl2O3.
What is the molecular weight of 1,4-Benzodioxan-2-methanol, 6,7-dichloro-?
The molecular weight of 1,4-Benzodioxan-2-methanol, 6,7-dichloro- is 233.99 g/mol.
Where can I buy 1,4-Benzodioxan-2-methanol, 6,7-dichloro-?
You can request a quote for 1,4-Benzodioxan-2-methanol, 6,7-dichloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzodioxan-2-methanol, 6,7-dichloro-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzodioxan-2-methanol, 6,7-dichloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.