methyl N-cyano-N'-phenylcarbamimidothioate
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methyl N-cyano-N'-phenylcarbamimidothioate
structure -
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CAS No:
21504-96-1
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Formula:
C9H9N3S
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Chemical Name:
methyl N-cyano-N'-phenylcarbamimidothioate
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Synonyms:
S-methyl-N-cyano-N'-phenylisothiourea; 1-Phenyl-3-cyano-2-methyl-isothioharnstoff; 1-cyano-2-methyl-3-phenyl-isothiourea; N-Cyano-S-methyl-N'phenylisothiourea; phenylaminomethylthiomethylenecyanamide; methyl N-cyano-N'-phenylimidothiocarbamate; 3-phenylamino-5-amino-1H-1,2,4-triazole;Expand
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CAS No:
methyl N-cyano-N'-phenylcarbamimidothioate Basic Attributes
191.25300
191.05171847
DTXSID20374098
2930909090
Characteristics
73.48000
2.37158
1.13g/cm3
185ºC
307.3ºC at 760 mmHg
139.6ºC
1.592
0.000733mmHg at 25°C
Computed Properties
Molecular Weight:191.26
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:191.05171847
Monoisotopic Mass:191.05171847
Topological Polar Surface Area:73.5
Heavy Atom Count:13
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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