4-(1-Adamantyl)-3-thiosemicarbazide

Base Information

• Chemical Name: 4-(1-Adamantyl)-3-thiosemicarbazide
• CAS No.: 52662-65-4
• Molecular Formula: C11H19N3S
• Molecular Weight: 225.35
• Hs Code.: 2930909090
• European Community (EC) Number: 673-044-7
• DSSTox Substance ID: DTXSID20354052
• Nikkaji Number: J2.676.033J
• Mol file: 52662-65-4.mol

Synonyms:4-(1-Adamantyl)-3-thiosemicarbazide;52662-65-4;n-(adamantan-1-yl)hydrazinecarbothioamide;1-(1-adamantyl)-3-aminothiourea;1-(adamantan-1-yl)-3-aminothiourea;Zincnitratehexahydrate;ChemDiv3_000039;1-Adamantylthiosemicarbazide;SCHEMBL455419;4-(1-adamantyl)thiosemicarbazide;DTXSID20354052;1-adamantan-1-yl-3-aminothiourea;HMS1473B17;CCA66265;MFCD00079698;AKOS001584980;N-(1-Adamantyl)hydrazinecarbothioamide;SB85974;IDI1_019357;NCGC00175359-01;BS-28523;N-(1-Adamantyl)hydrazinecarbothioamide #;CS-0207217;FT-0682143;AB00082357-01;A829188

Chemical Property of 4-(1-Adamantyl)-3-thiosemicarbazide

Chemical Property:

• Vapor Pressure: 6.12E-05mmHg at 25°C
• Melting Point: 196-197°C
• Refractive Index: 1.636
• Boiling Point: 345.5°Cat760mmHg
• PKA: 11.66±0.20(Predicted)
• Flash Point: 162.8°C
• PSA: 82.17000
• Density: 1.24g/cm³
• LogP: 2.77510
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 225.12996879
• Heavy Atom Count: 15
• Complexity: 248

Purity/Quality:

98%min ^*data from raw suppliers

4-(1-Adamantyl)-3-thiosemicarbazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2CC3CC1CC(C2)(C3)NC(=S)NN