5-Fluoropyridine-2-carboxylic Acid - CAS 107504-08-5

Catalog:	BB002092
Product Name:	5-Fluoropyridine-2-carboxylic Acid
CAS:	107504-08-5
Synonyms:	5-fluoro-2-pyridinecarboxylic acid; 5-fluoropyridine-2-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	5-fluoropyridine-2-carboxylic acid
Description:	5-Fluoropyridine-2-carboxylic Acid (CAS# 107504-08-5) is a useful research chemical.
Molecular Weight:	141.10
Molecular Formula:	C6H4FNO2
Canonical SMILES:	C1=CC(=NC=C1F)C(=O)O
InChI:	InChI=1S/C6H4FNO2/c7-4-1-2-5(6(9)10)8-3-4/h1-3H,(H,9,10)
InChI Key:	JTKFIIQGMVKDNZ-UHFFFAOYSA-N
Boiling Point:	275.1 °C at 760 mmHg
Density:	1.419 g/cm³
LogP:	0.91890

Publication Number	Title	Priority Date
JP-2021137726-A	Iron complex, catalyst, electrode, water decomposition method and carbon dioxide decomposition method	20200304
KR-20200021494-A	Novel nucleoside or nucleotide derivatives, and use thereof	20200220
KR-102145025-B1	Novel nucleoside or nucleotide derivatives, and use thereof	20200220
WO-2021154966-A1	Compounds and compositions for use in treating skin disorders	20200129
WO-2021143922-A1	Crystal form and salt form of bromine domain protein inhibitor and preparation method therefor	20200119

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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:	140
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	141.02260653
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	141.02260653
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8