1-Pyrrolebutyric acid, 2,5-dimethyl-
TL;DR: 1-Pyrrolebutyric acid, 2,5-dimethyl- (CAS 110525-48-9) is a chemical compound with molecular formula C10H15NO2 and molecular weight 181.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,5-dimethylpyrrol-1-yl)butanoic acid
Also Known As: 1-Pyrrolebutyric acid, 2,5-dimethyl-, 4-(2,5-Dimethyl-1H-pyrrol-1-yl)butanoic acid, 4-(2,5-dimethylpyrrol-1-yl)butanoic acid, 2,5-Dimetil-1H-pirrol-il-butanoico, 2,5-Dimethyl-1H-pyrrol-1-yl-butanoic acid
| Molecular Formula | C10H15NO2 |
|---|---|
| Molecular Weight | 181.11 g/mol |
| LogP | 1.96974 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.11028 |
| Heavy Atoms | 13 |
| Complexity | 282.37344 |
Chemical Identifiers
| CAS Number | 110525-48-9 |
|---|---|
| SMILES | CC1=CC=C(N1CCCC(=O)O)C |
Product Overview
1-Pyrrolebutyric acid, 2,5-dimethyl- (CAS 110525-48-9), with molecular formula C10H15NO2 and molecular weight 181.11 g/mol. IUPAC: 4-(2,5-dimethylpyrrol-1-yl)butanoic acid.
Chemical Property Profile of 1-Pyrrolebutyric acid, 2,5-dimethyl-
Property Insights of 1-Pyrrolebutyric acid, 2,5-dimethyl-
The XLogP value of 1.96974 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolebutyric acid, 2,5-dimethyl-. With a topological polar surface area (TPSA) of 42.23 Ų, 1-Pyrrolebutyric acid, 2,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolebutyric acid, 2,5-dimethyl- has 1 hydrogen bond donor(s) and 1 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-Pyrrolebutyric acid, 2,5-dimethyl-?
The CAS number of 1-Pyrrolebutyric acid, 2,5-dimethyl- is 110525-48-9.
What is the molecular formula of 1-Pyrrolebutyric acid, 2,5-dimethyl-?
The molecular formula of 1-Pyrrolebutyric acid, 2,5-dimethyl- is C10H15NO2.
What is the molecular weight of 1-Pyrrolebutyric acid, 2,5-dimethyl-?
The molecular weight of 1-Pyrrolebutyric acid, 2,5-dimethyl- is 181.11 g/mol.
Where can I buy 1-Pyrrolebutyric acid, 2,5-dimethyl-?
You can request a quote for 1-Pyrrolebutyric acid, 2,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolebutyric acid, 2,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolebutyric acid, 2,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.