![1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- structure](/static/products/5501/55012-81-2.webp)
1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-
TL;DR: 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- (CAS 55012-81-2) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-formyl-3-oxo-1,2,5,6-tetrahydropyrrolo[1,2-a]azepine-5-carboxylic acid
Also Known As: 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-, 7-Formyl-2,3,5,6-tetrahydro-3-oxo-1H-pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-3-oxo-1,2,5,6-tetrahydropyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-3-oxo-1H,2H,3H,5H,6H-pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-Formyl-2,3,5,6-tetrahydro-3-oxo-1H-pyrrolo[1,2-a]azepine-5-carboxylicacid
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 55012-81-2 |
|---|---|
| SMILES | C1CC(=O)N2C1=CC=C(CC2C(=O)O)C=O |
| InChIKey | HSUPWVFGCHBFBF-UHFFFAOYSA-N |
Product Overview
1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- (CAS 55012-81-2), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: 7-formyl-3-oxo-1,2,5,6-tetrahydropyrrolo[1,2-a]azepine-5-carboxylic acid.
Chemical Property Profile of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-
Property Insights of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-
The XLogP value of -0.2 indicates that 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-. Following Lipinski's Rule of Five, 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- 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
Frequently Asked Questions
What is the CAS number of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-?
The CAS number of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- is 55012-81-2.
What is the molecular formula of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-?
The molecular formula of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- is C11H11NO4.
What is the molecular weight of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-?
The molecular weight of 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- is 221.07 g/mol.
Where can I buy 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-?
You can request a quote for 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrolo[1,2-a]azepine-5-carboxylic acid, 7-formyl-2,3,5,6-tetrahydro-3-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.