4-(2-羟丙氧基)-4-氧代丁-2-烯酸
TL;DR: 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 (CAS 10099-73-7) is a chemical compound with molecular formula C7H10O5 and molecular weight 174.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-羟丙氧基)-4-氧代丁-2-烯酸
4-(2-hydroxypropoxy)-4-oxobut-2-enoic acid
Also Known As: 4-(2-hydroxypropoxy)-4-oxobut-2-enoic acid, (Z)-4-(2-hydroxypropoxy)-4-oxobut-2-enoic acid, (Z)-4-(3-hydroxypropoxy)-4-oxobut-2-enoic acid, 2-Butenedioic acid(2Z)-, mono(2-hydroxypropyl) ester (9CI)
| Molecular Formula | C7H10O5 |
|---|---|
| Molecular Weight | 174.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 174.05283 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 10099-73-7 |
|---|---|
| SMILES | CC(COC(=O)C=CC(=O)O)O |
| InChIKey | ZKXXLNRGNAUYHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-羟丙氧基)-4-氧代丁-2-烯酸 (CAS 10099-73-7), with molecular formula C7H10O5 and molecular weight 174.05 g/mol. IUPAC: 4-(2-hydroxypropoxy)-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸
Property Insights of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸
The XLogP value of -0.4 indicates that 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-羟丙氧基)-4-氧代丁-2-烯酸. Following Lipinski's Rule of Five, 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 has 2 hydrogen bond donor(s) and 5 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 4-(2-羟丙氧基)-4-氧代丁-2-烯酸?
The CAS number of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 is 10099-73-7.
What is the molecular formula of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸?
The molecular formula of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 is C7H10O5.
What is the molecular weight of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸?
The molecular weight of 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 is 174.05 g/mol.
Where can I buy 4-(2-羟丙氧基)-4-氧代丁-2-烯酸?
You can request a quote for 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-羟丙氧基)-4-氧代丁-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-羟丙氧基)-4-氧代丁-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.