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Home >> Chemical Listing >> Page 2972 >> 4-[(Cyanocarbonothioyl)amino]benzoic acid

4-[(Cyanocarbonothioyl)amino]benzoic acid
[CAS# 90418-66-9]

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Identification
Name 4-[(Cyanocarbonothioyl)amino]benzoic acid
Synonyms 4-((cyanocarbonothioyl)amino)benzoic acid
Molecular Structure CAS#: 90418-66-9, 4-[(Cyanocarbonothioyl)amino]benzoic acid
Molecular Formula C9H6N2O2S
Molecular Weight 206.22
CAS Registry Number 90418-66-9
SMILES c1cc(ccc1C(=O)O)NC(=S)C#N
InChI 1S/C9H6N2O2S/c10-5-8(14)11-7-3-1-6(2-4-7)9(12)13/h1-4H,(H,11,14)(H,12,13)
InChIKey CMWNDKYKKBIIJL-UHFFFAOYSA-N
Properties
Density 1.513g/cm3 (Cal.)
Boiling point 381.095°C at 760 mmHg (Cal.)
Flash point 184.28°C (Cal.)
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