Methanethiol, N-(3,4-dimethylbenzyl)amidino-, hydrogen thiosulfate

Base Information

• Chemical Name: Methanethiol, N-(3,4-dimethylbenzyl)amidino-, hydrogen thiosulfate
• CAS No.: 63869-36-3
• Molecular Formula: C11H16 N2 O3 S2
• Molecular Weight: 288.3863
• NSC Number: 187526
• DSSTox Substance ID: DTXSID40213354
• Nikkaji Number: J85.440I
• Mol file: 63869-36-3.mol

Synonyms:63869-36-3;Methanethiol, N-(3,4-dimethylbenzyl)amidino-, hydrogen thiosulfate;S-((N-(3,4-Dimethylbenzyl)amidino)methyl) hydrogen thiosulfate;NSC187526;NSC 187526;DTXSID40213354;SJTMUPFIWQTRER-UHFFFAOYSA-N;NSC-187526;N-[3,4-Dimethylbenzylcarboxamidino]methanethiosurfuric acid;1,2-dimethyl-4-[[(2-sulfosulfanylethanimidoyl)amino]methyl]benzene;S-(2-((3,4-Dimethylbenzyl)amino)-2-iminoethyl) hydrogen thiosulfate;S-(2-[(3,4-Dimethylbenzyl)amino]-2-iminoethyl) hydrogen thiosulfate #;Thiosulfuric acid (H2S2O3), S-(((((3,4-dimethylphenyl)methyl)amino)imino)methyl) ester;Thiosulfuric acid (H2S2O3),4-dimethylphenyl)methyl]amino]imino]methyl] ester

Chemical Property of Methanethiol, N-(3,4-dimethylbenzyl)amidino-, hydrogen thiosulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 123.93000
• Density: 1.35g/cm³
• LogP: 3.47770
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 288.06023472
• Heavy Atom Count: 18
• Complexity: 390

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)CN=C(CSS(=O)(=O)O)N)C