![(E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one structure](/static/products/287/287398-98-5.png)
(E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one
TL;DR: (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one (CAS 287398-98-5) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-but-2-enoyl]-1,3-benzoxazol-2-one
Also Known As: 3-Crotonoyl-2,3-dihydrobenzoxazole-2-one, (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one, J2.709.560G, 3-[(E)-but-2-enoyl]-1,3-benzoxazol-2-one, 3-[(2E)-but-2-enoyl]-2,3-dihydro-1,3-benzoxazol-2-one
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 1.8108 |
| Topological Polar Surface Area | 52.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 589.144 |
Chemical Identifiers
| CAS Number | 287398-98-5 |
|---|---|
| SMILES | C/C=C/C(=O)N1C2=CC=CC=C2OC1=O |
Product Overview
(E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one (CAS 287398-98-5), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: 3-[(E)-but-2-enoyl]-1,3-benzoxazol-2-one.
Chemical Property Profile of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one
Property Insights of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one
The XLogP value of 1.8108 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one. With a topological polar surface area (TPSA) of 52.21 Ų, (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one has 0 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 (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one?
The CAS number of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one is 287398-98-5.
What is the molecular formula of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one?
The molecular formula of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one is C11H9NO3.
What is the molecular weight of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one?
The molecular weight of (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one is 203.06 g/mol.
Where can I buy (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one?
You can request a quote for (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(but-2-enoyl)benzo[d]oxazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.