3-Methyl-2-oxazolidinone - CAS 19836-78-3

Catalog:	BB015337
Product Name:	3-Methyl-2-oxazolidinone
CAS:	19836-78-3
Synonyms:	3-methyl-1,3-oxazolidin-2-one

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	3-methyl-1,3-oxazolidin-2-one
Description:	3-Methyl-2-oxazolidinone (CAS# 19836-78-3 ) is a useful research chemical.
Molecular Weight:	101.10
Molecular Formula:	C4H7NO2
Canonical SMILES:	CN1CCOC1=O
InChI:	InChI=1S/C4H7NO2/c1-5-2-3-7-4(5)6/h2-3H2,1H3
InChI Key:	VWIIJDNADIEEDB-UHFFFAOYSA-N
Boiling Point:	87-90 °C1 mmHg (lit.)
Melting Point:	15 °C(lit.)
Purity:	95 %
Density:	1.157 g/cm³
Appearance:	Colorless to pale yellow liquid
MDL:	MFCD00009759
LogP:	0.00630

Publication Number	Title	Priority Date
CN-112823438-A	Lithium ion battery	20190417
CN-113508493-A	Electrospun composite membrane for electrochemical device and application thereof	20190321
CN-113330608-A	Electrode with electrode additive for high performance batteries and use thereof	20190211
WO-2020149199-A1	Secondary battery	20190116
CN-113228344-A	Negative electrode material for lithium ion secondary battery, method for producing negative electrode material for lithium ion secondary battery, negative electrode for lithium ion secondary battery, and lithium ion secondary battery	20190104

PMID	Publication Date	Title	Journal
21711629	20110118	A cylindrical core-shell-like TiO2 nanotube array anode for flexible fiber-type dye-sensitized solar cells	Nanoscale research letters
21580161	20091204	Ammonium hydrogen (RS)-[(5-methyl-2-oxo-1,3-oxazolidin-3-yl)meth-yl]phospho-nate	Acta crystallographica. Section E, Structure reports online
19473017	20090709	Design of HIV-1 protease inhibitors with pyrrolidinones and oxazolidinones as novel P1'-ligands to enhance backbone-binding interactions with protease: synthesis, biological evaluation, and protein-ligand X-ray studies	Journal of medicinal chemistry

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Related Functional Groups

Oxazolines/Oxazolidines

[22876-17-1]
6-Amino-2-benzoxazolinone
[196404-55-4]
3-tert-Butoxycarbony-2-(4-anisyl)-4-phenyl-5-oxazolidinecarboxylic acid
[59719-53-8]
16-Doxyl-stearic acid methyl ester
[497-25-6]
2-Oxazolidinone
[7127-19-7]
2-Phenyl-2-oxazoline
[670254-71-4]
5-Methyl 3-(2-methyl-2-propanyl) (4S,5R)-2-(4-methoxyphenyl)-4-phenyl-1,3-oxazolidine-3,5-dicarboxylate

GHS Hazard Statement:	H318 (49.43%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P273, P280, P305+P351+P338, P310, P391, and P501
Signal Word:	Danger

Complexity:	91.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	101.047678466
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	101.047678466
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1