N-allyl-4-fluorobenzamide
TL;DR: N-allyl-4-fluorobenzamide (CAS 39887-14-4) is a chemical compound with molecular formula C10H10FNO and molecular weight 179.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-prop-2-enylbenzamide
Also Known As: N-allyl-4-fluorobenzamide, 4-fluoro-N-prop-2-enylbenzamide, Benzamide, 4-fluoro-N-allyl-, 4-fluoro-N-prop-2-enyl-benzamide, 4-fluoro-N-(prop-2-en-1-yl)benzamide
| Molecular Formula | C10H10FNO |
|---|---|
| Molecular Weight | 179.07 g/mol |
| LogP | 1.7415 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.07465 |
| Heavy Atoms | 13 |
| Complexity | 305.20572 |
Chemical Identifiers
| CAS Number | 39887-14-4 |
|---|---|
| SMILES | C=CCNC(=O)C1=CC=C(C=C1)F |
Product Overview
N-allyl-4-fluorobenzamide (CAS 39887-14-4), with molecular formula C10H10FNO and molecular weight 179.07 g/mol. IUPAC: 4-fluoro-N-prop-2-enylbenzamide.
Chemical Property Profile of N-allyl-4-fluorobenzamide
Property Insights of N-allyl-4-fluorobenzamide
The XLogP value of 1.7415 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-4-fluorobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-allyl-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-4-fluorobenzamide 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-4-fluorobenzamide?
The CAS number of N-allyl-4-fluorobenzamide is 39887-14-4.
What is the molecular formula of N-allyl-4-fluorobenzamide?
The molecular formula of N-allyl-4-fluorobenzamide is C10H10FNO.
What is the molecular weight of N-allyl-4-fluorobenzamide?
The molecular weight of N-allyl-4-fluorobenzamide is 179.07 g/mol.
Where can I buy N-allyl-4-fluorobenzamide?
You can request a quote for N-allyl-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.