2-(Methylthio)acetamide - CAS 22551-24-2

Name: 2-(Methylthio)acetamide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017665
Product Name:	2-(Methylthio)acetamide
CAS:	22551-24-2
Synonyms:	2-(methylthio)acetamide; 2-methylsulfanylacetamide

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-methylsulfanylacetamide
Description:	2-(Methylthio)acetamide (CAS# 22551-24-2) is a useful research chemical.
Molecular Weight:	105.16
Molecular Formula:	C3H7NOS
Canonical SMILES:	CSCC(=O)N
InChI:	InChI=1S/C3H7NOS/c1-6-2-3(4)5/h2H2,1H3,(H2,4,5)
InChI Key:	OBENGAMZEGRSIC-UHFFFAOYSA-N
Boiling Point:	258.8 °C at 760 mmHg
Density:	1.132 g/cm³
Solubility:	Other solvents(Soluble) : Methanol
Appearance:	Solid
MDL:	MFCD00041321
LogP:	0.53500

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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PMID	Publication Date	Title	Journal
20625387	20100701	Oxidation of Helix-3 methionines precedes the formation of PK resistant PrP	PLoS pathogens
20000701	20100114	Efficient alpha-(alkylthio)alkyl-type radical formation in (*)OH-induced oxidation of alpha-(methylthio)acetamide	The journal of physical chemistry. A
18680312	20080826	Methionine sulfoxides on PrPSc: a prion-specific covalent signature	Biochemistry
15912474	20050101	Iodoacetamide-alkylated methionine can mimic neutral loss of phosphoric acid from phosphopeptides as exemplified by nano-electrospray ionization quadrupole time-of-flight parent ion scanning	Rapid communications in mass spectrometry : RCM
15521767	20041110	Bimolecular homolytic substitution (S(H)2) reactions with hydrogen atoms. time-resolved electron spin resonance detection in the pulse radiolysis of alpha-(methylthio)acetamide	Journal of the American Chemical Society

Complexity:	54.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	105.02483502
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	105.02483502
Rotatable Bond Count:	2
Topological Polar Surface Area:	68.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2