![2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol structure](/static/products/4093/409304-46-7.webp)
2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol
TL;DR: 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol (CAS 409304-46-7) is a chemical compound with molecular formula C9H7ClN2O2 and molecular weight 210.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]phenol
Also Known As: 2-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]phenol, AB00086929-01, 3-chloromethyl-5-(o-hydroxyphenyl)-1,2,4-oxa-diazole, (6Z)-6-[3-(chloromethyl)-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,4-dien-1-one, 6-[3-(chloromethyl)-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C9H7ClN2O2 |
|---|---|
| Molecular Weight | 210.02 g/mol |
| LogP | 2.181 |
| Topological Polar Surface Area | 59.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.0196 |
| Heavy Atoms | 14 |
| Complexity | 441.88193 |
Chemical Identifiers
| CAS Number | 409304-46-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC(=NO2)CCl)O |
Product Overview
2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol (CAS 409304-46-7), with molecular formula C9H7ClN2O2 and molecular weight 210.02 g/mol. IUPAC: 2-[3-(chloromethyl)-1,2,4-oxadiazol-5-yl]phenol.
Chemical Property Profile of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol
Property Insights of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol
The XLogP value of 2.181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol. With a topological polar surface area (TPSA) of 59.15 Ų, 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol has 1 hydrogen bond donor(s) and 4 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 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol?
The CAS number of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol is 409304-46-7.
What is the molecular formula of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol?
The molecular formula of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol is C9H7ClN2O2.
What is the molecular weight of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol?
The molecular weight of 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol is 210.02 g/mol.
Where can I buy 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol?
You can request a quote for 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.