N(6)-(3-Iodo-4-hydroxyphenyl)-1-isopropyladenosine

Base Information

• Chemical Name: N(6)-(3-Iodo-4-hydroxyphenyl)-1-isopropyladenosine
• CAS No.: 92530-58-0
• Molecular Formula: C19H22 I N5 O5
• Molecular Weight: 527.31295
• DSSTox Substance ID: DTXSID00919123
• Mol file: 92530-58-0.mol

Synonyms:4-IHPIA;N(6)-(3-iodo-4-hydroxyphenyl)-1-isopropyladenosine

Chemical Property of N(6)-(3-Iodo-4-hydroxyphenyl)-1-isopropyladenosine

Chemical Property:

• Vapor Pressure: 1.03E-24mmHg at 25°C
• Boiling Point: 766.6°Cat760mmHg
• Flash Point: 417.4°C
• PSA: 145.78000
• Density: 1.98g/cm³
• LogP: 0.86410
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 6
• Exact Mass: 527.06657
• Heavy Atom Count: 30
• Complexity: 579

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CC(=C(C=C1)O)I)NC2=C3C(=NC=N2)N(C=N3)C4C(C(C(O4)CO)O)O
• Isomeric SMILES: C[C@H](CC1=CC(=C(C=C1)O)I)NC2=C3C(=NC=N2)N(C=N3)C4[C@@H]([C@@H]([C@H](O4)CO)O)O

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