2-Phenylisonicotinic Acid - CAS 55240-51-2

Catalog:	BB028964
Product Name:	2-Phenylisonicotinic Acid
CAS:	55240-51-2
Synonyms:	2-phenyl-4-pyridinecarboxylic acid; 2-phenylpyridine-4-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-phenylpyridine-4-carboxylic acid
Description:	2-Phenylisonicotinic Acid (CAS# 55240-51-2) is a useful research chemical.
Molecular Weight:	199.21
Molecular Formula:	C12H9NO2
Canonical SMILES:	C1=CC=C(C=C1)C2=NC=CC(=C2)C(=O)O
InChI:	InChI=1S/C12H9NO2/c14-12(15)10-6-7-13-11(8-10)9-4-2-1-3-5-9/h1-8H,(H,14,15)
InChI Key:	OMMKWOVBOKXXQU-UHFFFAOYSA-N
Boiling Point:	478.8 °C at 760 mmHg
Density:	1.241 g/cm³
MDL:	MFCD03086008
LogP:	2.44680

Publication Number	Title	Priority Date
WO-2021051231-A1	Photo-responsive coordination compounds with photo-controllable electron-transporting and electrical conducting properties, and fabrication of organic electronics and organic resistive memory devices with photo-switchable performance	20190916
CN-109053815-A	A kind of iridium (III) complex and its preparation method and application	20180921
WO-2019162323-A1	New benzimidazole compounds and derivatives as egfr inhibitors	20180221
US-2020377476-A1	New benzimidazole compounds and derivatives as egfr inhibitors	20180221
AU-2018359018-A1	Peptide antibiotics	20171102

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	224
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.063328530
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	199.063328530
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4