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Home >> Chemical Listing >> Page 2892 >> 3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid

3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid
[CAS# 888968-32-9]

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CAS#: 888968-32-9
Product: 3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid
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Identification
Name 3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid
Synonyms 3-(4-cyanopyridin-2-ylthio)benzoic acid; BENZOIC ACID,3-[(4-CYANO-2-PYRIDINYL)THIO]-
Molecular Structure CAS#: 888968-32-9, 3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid
Molecular Formula C13H8N2O2S
Molecular Weight 256.28
CAS Registry Number 888968-32-9
SMILES c1cc(cc(c1)Sc2cc(ccn2)C#N)C(=O)O
InChI 1S/C13H8N2O2S/c14-8-9-4-5-15-12(6-9)18-11-3-1-2-10(7-11)13(16)17/h1-7H,(H,16,17)
InChIKey BHISMDNETRVLDY-UHFFFAOYSA-N
Properties
Density 1.443g/cm3 (Cal.)
Boiling point 502.039°C at 760 mmHg (Cal.)
Flash point 257.424°C (Cal.)
Refractive index 1.693 (Cal.)
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List of Reports Available for 3-[(4-cyano-2-pyridyl)sulfanyl]benzoic acid
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