1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime
TL;DR: 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime (CAS 259544-87-1) is a chemical compound with molecular formula C7H10N2O and molecular weight 138.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]hydroxylamine
Also Known As: 3-Butoxypropylamine, 1H-Pyrrole-2-carboxaldehyde,3,5-dimethyl-, oxime, 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime, 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime (9CI)
| Molecular Formula | C7H10N2O |
|---|---|
| Molecular Weight | 138.08 g/mol |
| LogP | 1.43964 |
| Topological Polar Surface Area | 48.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.07932 |
| Heavy Atoms | 10 |
| Complexity | 250.10883 |
Chemical Identifiers
| CAS Number | 259544-87-1 |
|---|---|
| SMILES | CC1=CC(=C(N1)C=NO)C |
Product Overview
1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime (CAS 259544-87-1), with molecular formula C7H10N2O and molecular weight 138.08 g/mol. IUPAC: N-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]hydroxylamine.
Chemical Property Profile of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime
Property Insights of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime
The XLogP value of 1.43964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime. With a topological polar surface area (TPSA) of 48.38 Ų, 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime has 2 hydrogen bond donor(s) and 2 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-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime?
The CAS number of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime is 259544-87-1.
What is the molecular formula of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime?
The molecular formula of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime is C7H10N2O.
What is the molecular weight of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime?
The molecular weight of 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime is 138.08 g/mol.
Where can I buy 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime?
You can request a quote for 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole-2-carboxaldehyde, 3,5-dimethyl-, oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.