Potassium 3-Indoleacetate - CAS 2338-19-4

Catalog:	BB018027
Product Name:	Potassium 3-Indoleacetate
CAS:	2338-19-4
Synonyms:	potassium;2-(1H-indol-3-yl)acetate; potassium;2-(1H-indol-3-yl)acetate

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Computed Properties

IUPAC Name:	potassium;2-(1H-indol-3-yl)acetate
Description:	Potassium 3-Indoleacetate (CAS# 2338-19-4) is a useful research chemical.
Molecular Weight:	213.27
Molecular Formula:	C10H8NO2K
Canonical SMILES:	C1=CC=C2C(=C1)C(=CN2)CC(=O)[O-].[K+]
InChI:	InChI=1S/C10H9NO2.K/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9;/h1-4,6,11H,5H2,(H,12,13);/q;+1/p-1
InChI Key:	MLWMEUAQPRACHM-UHFFFAOYSA-M
Boiling Point:	415 °C at 760 mmHg
Appearance:	Solid
LogP:	0.46030

Publication Number	Title	Priority Date
SK-7512-Y1	Liquid concentrates of secondary and/or trace of plant nutrients and their use	20151111
CN-105230313-B	A kind of implantation methods of Zanthoxylum schinifolium	20151105
EP-2218754-A1	Polyimide composite material and film of the same	20071130
EP-2218754-B1	Polyimide composite material and film of the same	20071130
JP-5462631-B2	Polyimide composite material and film thereof	20071130

PMID	Publication Date	Title	Journal
15859471	20050301	[Growth-regulating activity of N-benzyl- and O-benzyl-containing compounds belonging to a new group of synthetic analogues of natural auxins]	Prikladnaia biokhimiia i mikrobiologiia

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	210
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.01920998
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	213.01920998
Rotatable Bond Count:	2
Topological Polar Surface Area:	55.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0