Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate
TL;DR: Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate (CAS 155345-20-3) is a chemical compound with molecular formula C9H13NO4 and molecular weight 199.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate
Also Known As: Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate, methyl 5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate, Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate #, (1H)Pyrrole-3-carboxylic acid, 5-(hydroxymethyl)-1-(methoxymethyl)-, methyl ester, 1H-Pyrrole-3-carboxylic acid, 5-(hydroxymethyl)-1-(methoxymethyl)-, methyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H13NO4 |
| Molecular Weight | 199.08446 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.08446 Da |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
| SMILES | COCN1C=C(C=C1CO)C(=O)OC |
| InChIKey | UCSNZROZZCHLKG-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate
Property Insights of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate
The XLogP value of -0.5 indicates that Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate?
The CAS number of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate is 155345-20-3.
What is the molecular formula of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate?
The molecular formula of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate is C9H13NO4.
What is the molecular weight of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate?
The molecular weight of Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate is 199.08446 g/mol.
Where can I buy Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate?
You can request a quote for Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 5-(hydroxymethyl)-1-(methoxymethyl)-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.