(Trimethylsilyl)acetic acid - CAS 2345-38-2

Catalog:	BB018062
Product Name:	(Trimethylsilyl)acetic acid
CAS:	2345-38-2
Synonyms:	2-trimethylsilylacetic acid

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Computed Properties

IUPAC Name:	2-trimethylsilylacetic acid
Description:	(Trimethylsilyl)acetic acid (CAS# 2345-38-2 ) is a useful research chemical.
Molecular Weight:	132.23
Molecular Formula:	C5H12O2Si
Canonical SMILES:	C[Si](C)(C)CC(=O)O
InChI:	InChI=1S/C5H12O2Si/c1-8(2,3)4-5(6)7/h4H2,1-3H3,(H,6,7)
InChI Key:	JDMMZVAKMAONFU-UHFFFAOYSA-N
Boiling Point:	132.24 ℃
Melting Point:	39-42 ℃
Purity:	> 97.0 % (T)
Density:	0.934 g/cm³
Appearance:	White crystals and/or chunks
Storage:	2-8 ℃
MDL:	MFCD00042651
LogP:	1.40920

Publication Number	Title	Priority Date
CN-113072448-A	Aryl gemfibrozil derivative high-valence iodine compound and preparation method thereof	20210331
CN-112759910-A	Biodegradable polylactic acid film	20210218
CN-111943874-A	Aryl naproxen derivative high-valence iodine compound and preparation method and application thereof	20200814
CN-111423870-A	Quantum dot structure, manufacturing method thereof and quantum dot light-emitting device	20200330
WO-2021195882-A1	Quantum dot structure and manufacturing method therefor, and quantum dot light-emitting device	20200330

PMID	Publication Date	Title	Journal
19630376	20090821	Introduction of the (-)-berkelic acid side chain and assignment of the C-22 stereochemistry	The Journal of organic chemistry
17295498	20070315	N-heterocyclic carbene-catalyzed Mukaiyama aldol reactions	Organic letters
16855708	20060807	Phosphazene base-catalyzed condensation of trimethylsilylacetate with carbonyl compounds	Chemical communications (Cambridge, England)
15534719	20041121	Enantioselective catalysis in water: Mukaiyama-aldol condensation promoted by copper complexes of bisoxazolines supported on poly(ethylene glycol)	Organic & biomolecular chemistry
14709879	20040101	Chiral ligand-controlled asymmetric conjugate addition of alpha-trimethylsilanylacetate to acyclic and cyclic enones	Chemical & pharmaceutical bulletin

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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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	93.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.060656156
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	132.060656156
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0