3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)
TL;DR: 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) (CAS 63916-82-5) is a chemical compound with molecular formula C14H18ClFINO3 and molecular weight 429.0004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-morpholin-4-ium-4-ylpropyl 4-fluoro-3-iodobenzoate chloride
Also Known As: Hydrochloride of the 3-(4-morpholino)propyl-3-iodo-4-fluorobenzoate, BENZOIC ACID, 4-FLUORO-3-IODO-, 3-(4-MORPHOLINO)PROPYL ESTER, HYDROCHLORIDE, 3-morpholin-4-ium-4-ylpropyl 4-fluoro-3-iodobenzoate chloride, Benzoic acid, 4-fluoro-3-iodo-, 3-(4-morpholinyl)propyl ester, 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C14H18ClFINO3 |
| Molecular Weight | 429.0004 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.0004 Da |
| Heavy Atoms | 21 |
| Complexity | 313.0 |
| SMILES | C1COCC[NH+]1CCCOC(=O)C2=CC(=C(C=C2)F)I.[Cl-] |
| InChIKey | ZOPFXVXOZZFVGS-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)
Property Insights of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)
The XLogP value of -2.1 indicates that 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.0 Ų, 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)?
The CAS number of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) is 63916-82-5.
What is the molecular formula of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)?
The molecular formula of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) is C14H18ClFINO3.
What is the molecular weight of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)?
The molecular weight of 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) is 429.0004 g/mol.
Where can I buy 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)?
You can request a quote for 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for 3-(Morpholin-4-yl)propyl 4-fluoro-3-iodobenzoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.