ZERO/005239
TL;DR: ZERO/005239 (CAS 3663-79-4) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
Also Known As: ZERO/005239, J1.995.251G, (R)-2,3-Dihydro-1,4-benzodioxin-2-carboxylic acid methyl ester, METHYL (2R)-2,3-DIHYDRO-1,4-BENZODIOXINE-2-CARBOXYLATE, methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 3663-79-4 |
|---|---|
| SMILES | COC(=O)[C@H]1COC2=CC=CC=C2O1 |
| InChIKey | SNLAAGHHNZECPE-SECBINFHSA-N |
Product Overview
ZERO/005239 (CAS 3663-79-4), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate.
Chemical Property Profile of ZERO/005239
Property Insights of ZERO/005239
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ZERO/005239. With a topological polar surface area (TPSA) of 44.8 Ų, ZERO/005239 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ZERO/005239 has 0 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 ZERO/005239?
The CAS number of ZERO/005239 is 3663-79-4.
What is the molecular formula of ZERO/005239?
The molecular formula of ZERO/005239 is C10H10O4.
What is the molecular weight of ZERO/005239?
The molecular weight of ZERO/005239 is 194.06 g/mol.
Where can I buy ZERO/005239?
You can request a quote for ZERO/005239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZERO/005239?
Yes, KEHONG BIO provides custom synthesis services for ZERO/005239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.