2-Ethoxy-2-methylpropionic Acid - CAS 15001-71-5

Catalog:	BB010474
Product Name:	2-Ethoxy-2-methylpropionic Acid
CAS:	15001-71-5
Synonyms:	2-ethoxy-2-methylpropanoic acid; 2-ethoxy-2-methylpropanoic acid

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Computed Properties

IUPAC Name:	2-ethoxy-2-methylpropanoic acid
Description:	2-Ethoxy-2-methylpropionic Acid (CAS# 15001-71-5) is a useful research chemical.
Molecular Weight:	132.16
Molecular Formula:	C6H12O3
Canonical SMILES:	CCOC(C)(C)C(=O)O
InChI:	InChI=1S/C6H12O3/c1-4-9-6(2,3)5(7)8/h4H2,1-3H3,(H,7,8)
InChI Key:	ZCGZOPIPEZCKKQ-UHFFFAOYSA-N
Boiling Point:	222.3 °C at 760 mmHg
Density:	1.027 g/cm³
MDL:	MFCD14636712
LogP:	0.88610

Publication Number	Title	Priority Date
US-2021171530-A1	Ion channel modulators	20191126
WO-2021105086-A1	Non-thiol nitrogen based hydrophobic polymer brush materials and use thereof for modification of substrate surfaces	20191126
WO-2021059846-A1	Near-infrared absorption composition, film, optical filter and manufacturing method thereof, solid-state imaging element, infrared sensor, camera module, and inkjet ink	20190926
WO-2021039253-A1	Composition, film, optical filter and method for producing same, solid-state imaging element, infrared sensor and sensor module	20190830
WO-2021039205-A1	Composition, film, near-infrared cut-off filter, pattern formation method, laminate, solid-state imaging element, infrared sensor, image display device, camera module and compound	20190829

PMID	Publication Date	Title	Journal
21790171	20110905	Toward stereoselective lactide polymerization catalysts: cationic zinc complexes supported by a chiral phosphinimine scaffold	Inorganic chemistry

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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, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	107
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.078644241
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	132.078644241
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6