N-(3-(3-Hydroxy-4-methylphenyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid

Base Information

• Chemical Name: N-(3-(3-Hydroxy-4-methylphenyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid
• CAS No.: 155622-17-6
• Molecular Formula: C20H28 N2 O4 S2
• Molecular Weight: 424.5773
• DSSTox Substance ID: DTXSID20935249

Synonyms:N-(3-(3-Hydroxy-4-methylphenyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid;155622-17-6;Thiosulfuric acid, S-(2-(((3-(3-hydroxy-4-methylphenyl)tricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester;DTXSID20935249;C20H28N2O4S2;C20-H28-N2-O4-S2;LS-153410;S-[2-({[3-(3-Hydroxy-4-methylphenyl)adamantan-1-yl]methyl}amino)-2-iminoethyl] hydrogen sulfurothioate

Chemical Property of N-(3-(3-Hydroxy-4-methylphenyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.51g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 424.14904973
• Heavy Atom Count: 28
• Complexity: 719

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CN=C(CSS(=O)(=O)O)N)O

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