1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride
TL;DR: 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride (CAS 51572-89-5) is a chemical compound with molecular formula C7H9ClFNO and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)methoxyazanium chloride
Also Known As: 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride, (4-fluorophenyl)methoxyazanium Chloride, (4-fluorophenyl)methoxyazanium;chloride, [(4-Fluorophenyl)methoxy]ammonium chloride, (4-fluorophenyl)methoxyammonium;chloride
| Molecular Formula | C7H9ClFNO |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | -2.4968 |
| Topological Polar Surface Area | 36.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.03568 |
| Heavy Atoms | 11 |
| Complexity | 202.10048 |
Chemical Identifiers
| CAS Number | 51572-89-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CO[NH3+])F.[Cl-] |
Product Overview
1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride (CAS 51572-89-5), with molecular formula C7H9ClFNO and molecular weight 177.04 g/mol. IUPAC: (4-fluorophenyl)methoxyazanium chloride.
Chemical Property Profile of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride
Property Insights of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride
The XLogP value of -2.4968 indicates that 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.87 Ų, 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride 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 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride?
The CAS number of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride is 51572-89-5.
What is the molecular formula of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride?
The molecular formula of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride is C7H9ClFNO.
What is the molecular weight of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride?
The molecular weight of 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride is 177.04 g/mol.
Where can I buy 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride?
You can request a quote for 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Ammoniooxy)methyl]-4-fluorobenzene chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.