Einecs 257-829-8

Base Information

• Chemical Name: Einecs 257-829-8
• CAS No.: 52302-51-9
• Molecular Formula: C7H13N5S
• Molecular Weight: 197.26
• European Community (EC) Number: 257-829-8
• Mol file: 52302-51-9.mol

Synonyms:EINECS 257-829-8;52302-51-9;Thiocyanic acid, compound with 1,3,5,7-tetraazatricyclo(3.3.1.13,7)decane;FT-0640059

Chemical Property of Einecs 257-829-8

Chemical Property:

• Vapor Pressure: 0.019mmHg at 25°C
• Melting Point: 160-165 °C
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 252.7 °C at 760 mmHg
• Flash Point: 103.9 °C
• PSA: 62.05000
• Density: 1.1927 (rough estimate)
• LogP: -0.72782
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 199.08916661
• Heavy Atom Count: 13
• Complexity: 151

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 24/25

MSDS Files:

Useful:

• Canonical SMILES: C1[NH+]2CN3CN1CN(C2)C3.C(#N)[S-]