Acetic acid, (p-(1-pyrrolyl)phenyl)-
TL;DR: Acetic acid, (p-(1-pyrrolyl)phenyl)- (CAS 22048-71-1) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-pyrrol-1-ylphenyl)acetic acid
Also Known As: [4-(1H-pyrrol-1-yl)phenyl]acetic acid|(4-Pyrrol-1-yl-phenyl)-acetic acid|2-(4-(1H-pyrrol-1-yl)phenyl)acetic acid|2-(4-pyrrol-1-ylphenyl)acetic acid|[4- phenyl]aceticacid|4-(1-Pyrryl)phenylacetic acid|Benzeneacetic acid, 4-(1H-pyrrol-1-yl)-|Acido 4-(1-pirril)fenilacetco|Oprea1_211914|(p-(1-Pyrrolyl)phenyl)acetic acid|2-[4-(1H-pyrrol-1-yl)phenyl]acetic acid|p-(1-Pyrryl)-phenylessigsaeure|2-(4-pyrrolylphenyl)acetic acid|KS-00003TGD|4-(1-Pyrrolyl)phenylacetic Acid|[4-(pyrrol-1-yl)phenyl]acetic acid|N-(4-Carboxymethene)phenylpyrrole|Acido 4-(1-pirril)fenilacetco [Italian]|(4-Pyrrol-1-yl-phenyl)-aceticacid|ACETIC ACID, (p-(1-PYRROLYL)PHENYL)-|7524AD|2-[4-(1-pyrrolyl)phenyl]acetic acid|4-(1H-pyrrol-1-yl)phenylacetic Acid|2-(4-pyrrol-1-ylphenyl)ethanoic acid
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H11NO2 |
| Molecular Weight | 201.07898 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.07898 Da |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
| Solubility | >30.2 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | C1=CN(C=C1)C2=CC=C(C=C2)CC(=O)O |
| InChIKey | KCZGWRZYJZGMQW-UHFFFAOYSA-N |
Product Description
Applications: Acetic acid, (p-(1-pyrrolyl)phenyl)- is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Acetic acid, (p-(1-pyrrolyl)phenyl)- (CAS 22048-71-1) has the molecular formula C12H11NO2 and a molecular weight of 201.08 g/mol. Reported properties include a solubility: >30.2 [ug/mL] (The mean of the results at pH 7.4). Synonyms include [4-(1H-pyrrol-1-yl)phenyl]acetic acid and (4-Pyrrol-1-yl-phenyl)-acetic acid.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Acetic acid, (p-(1-pyrrolyl)phenyl)-
Property Insights of Acetic acid, (p-(1-pyrrolyl)phenyl)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (p-(1-pyrrolyl)phenyl)-. With a topological polar surface area (TPSA) of 42.2 Ų, Acetic acid, (p-(1-pyrrolyl)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (p-(1-pyrrolyl)phenyl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, (p-(1-pyrrolyl)phenyl)-?
The CAS number of Acetic acid, (p-(1-pyrrolyl)phenyl)- is 22048-71-1.
What is the molecular formula of Acetic acid, (p-(1-pyrrolyl)phenyl)-?
The molecular formula of Acetic acid, (p-(1-pyrrolyl)phenyl)- is C12H11NO2.
What is the molecular weight of Acetic acid, (p-(1-pyrrolyl)phenyl)-?
The molecular weight of Acetic acid, (p-(1-pyrrolyl)phenyl)- is 201.07898 g/mol.
What are the applications of Acetic acid, (p-(1-pyrrolyl)phenyl)-?
Acetic acid, (p-(1-pyrrolyl)phenyl)- is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy Acetic acid, (p-(1-pyrrolyl)phenyl)-?
You can request a quote for Acetic acid, (p-(1-pyrrolyl)phenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, (p-(1-pyrrolyl)phenyl)-?
Yes, CoreyChem provides custom synthesis services for Acetic acid, (p-(1-pyrrolyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.