1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane
TL;DR: 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane (CAS 61471-64-5) is a chemical compound with molecular formula C12H14F3NO2 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]acetic acid
Also Known As: (alpha-Methyl-m-trifluoromethylphenethylamino)acetic acid, Glycine,N-[1-methyl-2-[3-(trifluoromethyl)-phenyl]ethyl], s1475, 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]acetic acid, Glycine, N-[1-methyl-2-[3-(trifluoromethyl)phenyl]ethyl]-
| Molecular Formula | C12H14F3NO2 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.09766 |
| Heavy Atoms | 18 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 61471-64-5 |
|---|---|
| SMILES | CC(CC1=CC(=CC=C1)C(F)(F)F)NCC(=O)O |
| InChIKey | NCUBLDCIXRNHSQ-UHFFFAOYSA-N |
Product Overview
1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane (CAS 61471-64-5), with molecular formula C12H14F3NO2 and molecular weight 261.10 g/mol. IUPAC: 2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]acetic acid.
Chemical Property Profile of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane
Property Insights of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane. With a topological polar surface area (TPSA) of 49.3 Ų, 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane has 2 hydrogen bond donor(s) and 6 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-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane?
The CAS number of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane is 61471-64-5.
What is the molecular formula of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane?
The molecular formula of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane is C12H14F3NO2.
What is the molecular weight of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane?
The molecular weight of 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane is 261.10 g/mol.
Where can I buy 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane?
You can request a quote for 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Trifluoromethylphenyl)-2-(2-carboxymethyl)aminopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.