1(2H)-Phthalazinone, 4-(guanidinomethyl)-2-methyl-, hemisulfate

Base Information

• Chemical Name: 1(2H)-Phthalazinone, 4-(guanidinomethyl)-2-methyl-, hemisulfate
• CAS No.: 42558-61-2
• Molecular Formula: C22H28N10O6S
• Molecular Weight: 560.5861
• DSSTox Substance ID: DTXSID50195339

Synonyms:4-(Guanidinomethyl)-2-methyl-1-phthalazone hemisulfate;1(2H)-Phthalazinone, 4-(guanidinomethyl)-2-methyl-, hemisulfate;42558-61-2;DTXSID50195339;C11H13N5O.1/2H2O4S;LS-109280;C11-H13-N5-O.1/2H2-O4-S

Chemical Property of 1(2H)-Phthalazinone, 4-(guanidinomethyl)-2-methyl-, hemisulfate

Chemical Property:

• Vapor Pressure: 4.3E-08mmHg at 25°C
• Boiling Point: 444.4°Cat760mmHg
• Flash Point: 222.6°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 560.19139982
• Heavy Atom Count: 39
• Complexity: 453

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.CN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.OS(=O)(=O)O

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