3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-
TL;DR: 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- (CAS 88412-29-7) is a chemical compound with molecular formula C7H4ClNO3 and molecular weight 184.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-hydroxy-3H-1,3-benzoxazol-2-one
Also Known As: 6-chloro-5-hydroxy-3H-1,3-benzoxazol-2-one, 6-chloro-5-hydroxy-1,3-benzoxazol-2(3h)-one, 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-, 6-Chloro-5-hydroxybenzo[d]oxazol-2(3H)-one, 6-chloro-5-hydroxy-3H-benzooxazol-2-one
| Molecular Formula | C7H4ClNO3 |
|---|---|
| Molecular Weight | 184.99 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.98798 |
| Heavy Atoms | 12 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 88412-29-7 |
|---|---|
| SMILES | C1=C2C(=CC(=C1O)Cl)OC(=O)N2 |
| InChIKey | BUGQSHSQQQMZDL-UHFFFAOYSA-N |
Product Overview
3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- (CAS 88412-29-7), with molecular formula C7H4ClNO3 and molecular weight 184.99 g/mol. IUPAC: 6-chloro-5-hydroxy-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-
Property Insights of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-. With a topological polar surface area (TPSA) of 58.6 Ų, 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- 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 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-?
The CAS number of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- is 88412-29-7.
What is the molecular formula of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-?
The molecular formula of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- is C7H4ClNO3.
What is the molecular weight of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-?
The molecular weight of 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- is 184.99 g/mol.
Where can I buy 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-?
You can request a quote for 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,3-Benzoxazol-2-one, 6-chloro-5-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.