![1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- structure](/static/products/1746/1746-02-7.webp)
1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-
TL;DR: 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- (CAS 1746-02-7) is a chemical compound with molecular formula C34H22O6 and molecular weight 526.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[1-(4-benzoyloxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] benzoate
Also Known As: Phenolphthalein-dibenzoat, BAS 00431279, 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-, [4-[1-(4-benzoyloxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] benzoate, 4-{1-[4-(benzoyloxy)phenyl]-3-oxo-1,3-dihydro-2-benzofuran-1-yl}phenyl benzoate
| Molecular Formula | C34H22O6 |
|---|---|
| Molecular Weight | 526.14 g/mol |
| LogP | 6.5873 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 526.14166 |
| Heavy Atoms | 40 |
| Complexity | 1594.8876 |
Chemical Identifiers
| CAS Number | 1746-02-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6 |
Product Overview
1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- (CAS 1746-02-7), with molecular formula C34H22O6 and molecular weight 526.14 g/mol. IUPAC: [4-[1-(4-benzoyloxyphenyl)-3-oxo-2-benzofuran-1-yl]phenyl] benzoate.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-
Property Insights of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-
The XLogP value of 6.5873 indicates that 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-?
The CAS number of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- is 1746-02-7.
What is the molecular formula of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-?
The molecular formula of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- is C34H22O6.
What is the molecular weight of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-?
The molecular weight of 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- is 526.14 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]-?
You can request a quote for 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- 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, 3,3-bis[4-(benzoyloxy)phenyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 3,3-bis[4-(benzoyloxy)phenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.