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Home >> Chemical Listing >> Page 2126 >> 4-(5-Cyano-2-pyridinyl)benzoic acid

4-(5-Cyano-2-pyridinyl)benzoic acid
[CAS# 648898-11-7]

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Identification
Name 4-(5-Cyano-2-pyridinyl)benzoic acid
Synonyms 4-(5-Cyan-2-pyridinyl)benzoesäure; 4-(5-Cyano-2-pyridinyl)benzoic acid
Molecular Structure CAS#: 648898-11-7, 4-(5-Cyano-2-pyridinyl)benzoic acid
Molecular Formula C13H8N2O2
Molecular Weight 224.21
CAS Registry Number 648898-11-7
SMILES c1cc(ccc1c2ccc(cn2)C#N)C(=O)O
InChI 1S/C13H8N2O2/c14-7-9-1-6-12(15-8-9)10-2-4-11(5-3-10)13(16)17/h1-6,8H,(H,16,17)
InChIKey VDWDAPHWBRJBMV-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Boiling point 449.2±40.0°C at 760 mmHg (Cal.)
Flash point 225.5±27.3°C (Cal.)
Refractive index 1.656 (Cal.)
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