2-Bromo-2-methylpropionic acid - CAS 2052-01-9

Name: 2-Bromo-2-methylpropionic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB016038
Product Name:	2-Bromo-2-methylpropionic acid
CAS:	2052-01-9
Synonyms:	2-bromo-2-methylpropanoic acid

Technical Data

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Computed Properties

IUPAC Name:	2-bromo-2-methylpropanoic acid
Description:	2-Bromo-2-methylpropionic acid (CAS# 2052-01-9) is used in the Herceptin functionalization of polyhedral oligomeric silsesquioxane-conjugated oligomers-silica /iron oxide nanoparticles for tumor cell sorting.
Molecular Weight:	167.00
Molecular Formula:	C4H7BrO2
Canonical SMILES:	CC(C)(C(=O)O)Br
InChI:	InChI=1S/C4H7BrO2/c1-4(2,5)3(6)7/h1-2H3,(H,6,7)
InChI Key:	XXSPGBOGLXKMDU-UHFFFAOYSA-N
Boiling Point:	198-200 °C
Melting Point:	41-46 °C
Purity:	95 %
Density:	0.96 g/cm³
Appearance:	White powder
MDL:	MFCD00004168
LogP:	1.24450

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[87-88-7]C6H2Cl2O4
Chloranilic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[1016519-61-1]C8H10N2O2
2-(Methyl-2-pyridylamino)acetic Acid

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2015376271-A1	Dual pdgf/vegf antagonists	20140628
WO-2015200905-A2	Dual pdgf/vegf antagonists	20140628
WO-2015195053-A1	Stimulus-responsive core-shell particles	20140620
WO-2015192183-A1	Hetero functional binding systems	20140617
WO-2015176153-A1	Ppar modulators	20140523

PMID	Publication Date	Title	Journal
22272217	20120101	Targeting strategies for multifunctional nanoparticles in cancer imaging and therapy	Theranostics
22848174	20120101	Cellular interaction of folic acid conjugated superparamagnetic iron oxide nanoparticles and its use as contrast agent for targeted magnetic imaging of tumor cells	International journal of nanomedicine
21688776	20110726	Multifunctional colloids with optical, magnetic, and superhydrophobic properties derived from nucleophilic substitution-induced layer-by-layer assembly in organic media	ACS nano
21166396	20110110	Hemicellulose-based multifunctional macroinitiator for single-electron-transfer mediated living radical polymerization	Biomacromolecules
21587840	20100609	2-Oxo-4-trifluoro-meth-yl-2H-chromen-7-yl 2-bromo-2-methyl-propano-ate	Acta crystallographica. Section E, Structure reports online

Complexity:	87.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	165.96294
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	165.96294
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2