Butyryl Cyclic AMP

Base Information

• Chemical Name: Butyryl Cyclic AMP
• CAS No.: 34675-98-4
• Molecular Formula: C14H18N5O7P
• Molecular Weight: 399.2958
• DSSTox Substance ID: DTXSID80956157
• Mol file: 34675-98-4.mol

Synonyms:Butyryl Cyclic AMP;34675-98-4;Adenosine, cyclic 3',5'-(hydrogenphosphate), mono(1-oxobutyl) deriv.;C14H17N5O6P;DTXSID80956157;C14-H17-N5-O6-P;LS-15116;Adenosine, cyclic 3',5'-(hydrogen phosphate), mono(1-oxobutyl) deriv.;Adenosine, cyclic 3',5'-(hydrogenphosphate), mono(1-oxobutyl) deriv;6-(6-Amino-9H-purin-9-yl)-2-(butanoyloxy)-7-hydroxytetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one

Chemical Property of Butyryl Cyclic AMP

Chemical Property:

• Vapor Pressure: 5.06E-18mmHg at 25°C
• Boiling Point: 654.5°Cat760mmHg
• Flash Point: 349.6°C
• PSA: 170.72000
• Density: 1.96g/cm³
• LogP: 1.11480
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 399.09438493
• Heavy Atom Count: 27
• Complexity: 627

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OP1(=O)OCC2C(O1)C(C(O2)N3C=NC4=C(N=CN=C43)N)O
• Isomeric SMILES: CCCC(=O)OP1(=O)OC[C@@H]2[C@@H](O1)[C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O

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