1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-
TL;DR: 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- (CAS 61133-37-7) is a chemical compound with molecular formula C11H10O3 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-prop-2-enoxy-3H-2-benzofuran-1-one
Also Known As: 3-allyloxy-phthalide, 3-prop-2-enoxy-3H-2-benzofuran-1-one, 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-, 3-(Allyloxy)-2-benzofuran-1(3h)-one, 3-[(Prop-2-en-1-yl)oxy]-2-benzofuran-1(3H)-one
| Molecular Formula | C11H10O3 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.06299 |
| Heavy Atoms | 14 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 61133-37-7 |
|---|---|
| SMILES | C=CCOC1C2=CC=CC=C2C(=O)O1 |
| InChIKey | VUHVYYOSDKVVEP-UHFFFAOYSA-N |
Product Overview
1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- (CAS 61133-37-7), with molecular formula C11H10O3 and molecular weight 190.06 g/mol. IUPAC: 3-prop-2-enoxy-3H-2-benzofuran-1-one.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-
Property Insights of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-. With a topological polar surface area (TPSA) of 35.5 Ų, 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- 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 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-?
The CAS number of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- is 61133-37-7.
What is the molecular formula of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-?
The molecular formula of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- is C11H10O3.
What is the molecular weight of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-?
The molecular weight of 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- is 190.06 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-?
You can request a quote for 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 3-(2-propenyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.