1-Imino-1H-inden-3-amine monohydrochloride
TL;DR: 1-Imino-1H-inden-3-amine monohydrochloride (CAS 40951-52-8) is a chemical compound with molecular formula C9H9ClN2 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iminoinden-1-amine;hydrochloride
Also Known As: N-Tetradecylacrylamide, 3-iminoinden-1-amine hydrochloride, 3-iminoinden-1-amine,hydrochloride, 1-Imino-1H-inden-3-amine monohydrochloride, 1H-Inden-3-amine, 1-imino-, monohydrochloride
| Molecular Formula | C9H9ClN2 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 1.78947 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.04543 |
| Heavy Atoms | 12 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 40951-52-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC2=N)N.Cl |
| InChIKey | CGRJFYBAQDJOPJ-UHFFFAOYSA-N |
Product Overview
1-Imino-1H-inden-3-amine monohydrochloride (CAS 40951-52-8), with molecular formula C9H9ClN2 and molecular weight 180.05 g/mol. IUPAC: 3-iminoinden-1-amine;hydrochloride.
Chemical Property Profile of 1-Imino-1H-inden-3-amine monohydrochloride
Property Insights of 1-Imino-1H-inden-3-amine monohydrochloride
The XLogP value of 1.78947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Imino-1H-inden-3-amine monohydrochloride. With a topological polar surface area (TPSA) of 49.9 Ų, 1-Imino-1H-inden-3-amine monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Imino-1H-inden-3-amine monohydrochloride has 3 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 1-Imino-1H-inden-3-amine monohydrochloride?
The CAS number of 1-Imino-1H-inden-3-amine monohydrochloride is 40951-52-8.
What is the molecular formula of 1-Imino-1H-inden-3-amine monohydrochloride?
The molecular formula of 1-Imino-1H-inden-3-amine monohydrochloride is C9H9ClN2.
What is the molecular weight of 1-Imino-1H-inden-3-amine monohydrochloride?
The molecular weight of 1-Imino-1H-inden-3-amine monohydrochloride is 180.05 g/mol.
Where can I buy 1-Imino-1H-inden-3-amine monohydrochloride?
You can request a quote for 1-Imino-1H-inden-3-amine monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Imino-1H-inden-3-amine monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Imino-1H-inden-3-amine monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.