(2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester
TL;DR: (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester (CAS 68157-06-2) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(dimethylamino)-1,2,3,4-tetrahydronaphthalen-1-yl]acetate
Also Known As: (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester, Methyl [2-(dimethylamino)-1,2,3,4-tetrahydro-1-naphthalenyl]acetate, Methyl [2-(dimethylamino)-1,2,3,4-tetrahydro-1-naphthalenyl]acetate #, methyl 2-[2-(dimethylamino)-1,2,3,4-tetrahydronaphthalen-1-yl]acetate
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 68157-06-2 |
|---|---|
| SMILES | CN(C)C1CCC2=CC=CC=C2C1CC(=O)OC |
| InChIKey | VKYUFCMYSMOTGK-UHFFFAOYSA-N |
Product Overview
(2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester (CAS 68157-06-2), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: methyl 2-[2-(dimethylamino)-1,2,3,4-tetrahydronaphthalen-1-yl]acetate.
Chemical Property Profile of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester
Property Insights of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester has 0 hydrogen bond donor(s) and 3 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 (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester?
The CAS number of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester is 68157-06-2.
What is the molecular formula of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester?
The molecular formula of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester is C15H21NO2.
What is the molecular weight of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester?
The molecular weight of (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester is 247.16 g/mol.
Where can I buy (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester?
You can request a quote for (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (2-Dimethylamino-1,2,3,4-tetrahydro-naphthalen-1-yl)-acetic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.