2-tert-Butoxyacetic Acid - CAS 13211-32-0

Catalog:	BB007541
Product Name:	2-tert-Butoxyacetic Acid
CAS:	13211-32-0
Synonyms:	2-[(2-methylpropan-2-yl)oxy]acetic acid; 2-[(2-methylpropan-2-yl)oxy]acetic acid

Technical Data

Safety and Hazards

Patents

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Computed Properties

IUPAC Name:	2-[(2-methylpropan-2-yl)oxy]acetic acid
Description:	2-tert-Butoxyacetic Acid (CAS# 13211-32-0) is a useful research chemical.
Molecular Weight:	132.16
Molecular Formula:	C6H12O3
Canonical SMILES:	CC(C)(C)OCC(=O)O
InChI:	InChI=1S/C6H12O3/c1-6(2,3)9-4-5(7)8/h4H2,1-3H3,(H,7,8)
InChI Key:	HQLILHPGWSURBT-UHFFFAOYSA-N
Boiling Point:	222.3 °C at 760 mmHg
Density:	1.027 g/cm³
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD03452738
LogP:	0.88610

Publication Number	Title	Priority Date
CN-113307779-A	Heterocyclic substituted biphenyl compound, preparation method and application	20210525
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CN-113354811-A	Oxazoline polymer with side chain containing amino and/or hydroxyl, preparation method and application thereof	20200219
CN-111393444-A	Preparation method of abacavir hydroxy acetate	20190102
US-2021002208-A1	Derivatives of sobetirome	20180214

PMID	Publication Date	Title	Journal
21726773	20110801	Antitumor activities and interaction with DNA of oxaliplatin-type platinum complexes with linear or branched alkoxyacetates as leaving groups	Journal of inorganic biochemistry

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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:	101
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:	0.7