N-allyl-3-(trifluoromethyl)benzenecarboxamide
TL;DR: N-allyl-3-(trifluoromethyl)benzenecarboxamide (CAS 303144-91-4) is a chemical compound with molecular formula C11H10F3NO and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enyl-3-(trifluoromethyl)benzamide
Also Known As: N-allyl-3-(trifluoromethyl)benzenecarboxamide, N-prop-2-enyl-3-(trifluoromethyl)benzamide, N-(prop-2-en-1-yl)-3-(trifluoromethyl)benzamide, N-allyl-3-(trifluoromethyl)benzamide, Benzamide, 3-trifluoromethyl-N-allyl-
| Molecular Formula | C11H10F3NO |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.6212 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.07144 |
| Heavy Atoms | 16 |
| Complexity | 398.4613 |
Chemical Identifiers
| CAS Number | 303144-91-4 |
|---|---|
| SMILES | C=CCNC(=O)C1=CC(=CC=C1)C(F)(F)F |
Product Overview
N-allyl-3-(trifluoromethyl)benzenecarboxamide (CAS 303144-91-4), with molecular formula C11H10F3NO and molecular weight 229.07 g/mol. IUPAC: N-prop-2-enyl-3-(trifluoromethyl)benzamide.
Chemical Property Profile of N-allyl-3-(trifluoromethyl)benzenecarboxamide
Property Insights of N-allyl-3-(trifluoromethyl)benzenecarboxamide
The XLogP value of 2.6212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-3-(trifluoromethyl)benzenecarboxamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-allyl-3-(trifluoromethyl)benzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-3-(trifluoromethyl)benzenecarboxamide has 1 hydrogen bond donor(s) and 1 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 N-allyl-3-(trifluoromethyl)benzenecarboxamide?
The CAS number of N-allyl-3-(trifluoromethyl)benzenecarboxamide is 303144-91-4.
What is the molecular formula of N-allyl-3-(trifluoromethyl)benzenecarboxamide?
The molecular formula of N-allyl-3-(trifluoromethyl)benzenecarboxamide is C11H10F3NO.
What is the molecular weight of N-allyl-3-(trifluoromethyl)benzenecarboxamide?
The molecular weight of N-allyl-3-(trifluoromethyl)benzenecarboxamide is 229.07 g/mol.
Where can I buy N-allyl-3-(trifluoromethyl)benzenecarboxamide?
You can request a quote for N-allyl-3-(trifluoromethyl)benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-3-(trifluoromethyl)benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-3-(trifluoromethyl)benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.