1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)
TL;DR: 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) (CAS 16931-84-3) is a chemical compound with molecular formula C12H16ClNO and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(dimethylamino)methyl]-2,3-dihydroinden-1-one;hydrochloride
Also Known As: (+/-)-2-N,N-Dimethylaminomethyl-1-indanone, HCl, 2-((Dimethylamino)methyl)-2,3-dihydro-1H-inden-1-one hydrochloride, 2-[(dimethylamino)methyl]-2,3-dihydroinden-1-one;hydrochloride, 1H-Inden-1-one, 2,3-dihydro-2-((dimethylamino)methyl)-, hydrochloride, 2-(dimethylaminomethyl)-2,3-dihydroinden-1-one hydrochloride
| Molecular Formula | C12H16ClNO |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 2.025 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.09204 |
| Heavy Atoms | 15 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 16931-84-3 |
|---|---|
| SMILES | CN(C)CC1CC2=CC=CC=C2C1=O.Cl |
| InChIKey | MDMDVFGTTVMMRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) (CAS 16931-84-3), with molecular formula C12H16ClNO and molecular weight 225.09 g/mol. IUPAC: 2-[(dimethylamino)methyl]-2,3-dihydroinden-1-one;hydrochloride.
Chemical Property Profile of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)
Property Insights of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)
The XLogP value of 2.025 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 20.3 Ų, 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) has 1 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-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)?
The CAS number of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) is 16931-84-3.
What is the molecular formula of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)?
The molecular formula of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) is C12H16ClNO.
What is the molecular weight of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)?
The molecular weight of 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) is 225.09 g/mol.
Where can I buy 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)?
You can request a quote for 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Inden-1-one, 2-((dimethylamino)methyl)-2,3-dihydro-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.