1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride
TL;DR: 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride (CAS 71459-00-2) is a chemical compound with molecular formula C14H14ClNO and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-methyl-2,3-dihydrocyclopenta[a]naphthalen-1-one;hydrochloride
Also Known As: 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride, 2-amino-5-methyl-2,3-dihydrocyclopenta[a]naphthalen-1-one hydrochloride, 2-Amino-5-methyl-2,3-dihydro-1H-cyclopenta[a]naphthalen-1-one--hydrogen chloride (1/1)
| Molecular Formula | C14H14ClNO |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 2.63612 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 247.07639 |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 71459-00-2 |
|---|---|
| SMILES | CC1=CC2=C(C3=CC=CC=C13)C(=O)C(C2)N.Cl |
| InChIKey | NADIYGWJETWDLG-UHFFFAOYSA-N |
Product Overview
1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride (CAS 71459-00-2), with molecular formula C14H14ClNO and molecular weight 247.08 g/mol. IUPAC: 2-amino-5-methyl-2,3-dihydrocyclopenta[a]naphthalen-1-one;hydrochloride.
Chemical Property Profile of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride
Property Insights of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride
The XLogP value of 2.63612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride. With a topological polar surface area (TPSA) of 43.1 Ų, 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride 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-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride?
The CAS number of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride is 71459-00-2.
What is the molecular formula of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride?
The molecular formula of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride is C14H14ClNO.
What is the molecular weight of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride?
The molecular weight of 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride is 247.08 g/mol.
Where can I buy 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride?
You can request a quote for 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benz(e)inden-1-one, 2-amino-2,3-dihydro-5-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.