2-Ethyl-3-pyridinol - CAS 61893-02-5

Catalog:	BB065473
Product Name:	2-Ethyl-3-pyridinol
CAS:	61893-02-5
Synonyms:	2-Ethyl-3-hydroxypyridine

Technical Data

Computed Properties

IUPAC Name:	2-ethylpyridin-3-ol
Description:	2-Ethyl-3-pyridinol is a reagent in the preparation of 3-?hydroxypyridine with antioxidants properties.
Molecular Weight:	123.15
Molecular Formula:	C7H9NO
Canonical SMILES:	CCC1=C(C=CC=N1)O
InChI:	InChI=1S/C7H9NO/c1-2-6-7(9)4-3-5-8-6/h3-5,9H,2H2,1H3
InChI Key:	BYVJVUZSNXUNRW-UHFFFAOYSA-N
Solubility:	Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
Appearance:	Off-White to Pale Beige Solid
Storage:	-20°C
References:	Tilekeeva, U. M., et al. Farmakologiya i Toksikologiya (Moscow), 50, 74 (1987).

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Complexity:	85
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	123.068413911
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	123.068413911
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3