2-(3-Fluoro-4-methoxy-alpha-phenoxybenzyl)-3,4,5,6-tetrahydropyrimidine

Base Information

• Chemical Name: 2-(3-Fluoro-4-methoxy-alpha-phenoxybenzyl)-3,4,5,6-tetrahydropyrimidine
• CAS No.: 52963-62-9
• Molecular Formula: C18H19FN2O2
• Molecular Weight: 314.35
• DSSTox Substance ID: DTXSID30967435
• Nikkaji Number: J86.985F
• Mol file: 52963-62-9.mol

Synonyms:52963-62-9;2-(3-Fluoro-4-methoxy-alpha-phenoxybenzyl)-3,4,5,6-tetrahydropyrimidine;3,4,5,6-Tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)pyrimidine;2-[(3-fluoro-4-methoxyphenyl)(phenoxy)methyl]-1,4,5,6-tetrahydropyrimidine;Pyrimidine, 3,4,5,6-tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)-;DTXSID30967435

Chemical Property of 2-(3-Fluoro-4-methoxy-alpha-phenoxybenzyl)-3,4,5,6-tetrahydropyrimidine

Chemical Property:

• Vapor Pressure: 5.11E-10mmHg at 25°C
• Boiling Point: 510.1°C at 760 mmHg
• Flash Point: 262.3°C
• PSA: 42.85000
• Density: 1.2g/cm³
• LogP: 3.11060
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 314.14305602
• Heavy Atom Count: 23
• Complexity: 399

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C(C2=NCCCN2)OC3=CC=CC=C3)F