Ethyl 2,2-Difluoro-2-iodoacetate - CAS 7648-30-8

Catalog:	BB035584
Product Name:	Ethyl 2,2-Difluoro-2-iodoacetate
CAS:	7648-30-8
Synonyms:	2,2-difluoro-2-iodoacetic acid ethyl ester; ethyl 2,2-difluoro-2-iodoacetate

Technical Data

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Computed Properties

IUPAC Name:	ethyl 2,2-difluoro-2-iodoacetate
Description:	Ethyl 2,2-Difluoro-2-iodoacetate (CAS# 7648-30-8) is a useful research chemical.
Molecular Weight:	249.98
Molecular Formula:	C4H5F2IO2
Canonical SMILES:	CCOC(=O)C(F)(F)I
InChI:	InChI=1S/C4H5F2IO2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
InChI Key:	HGWXXIZVRRTDKT-UHFFFAOYSA-N
Boiling Point:	151.4 °C at 760 mmHg
Density:	1.955 g/cm³
LogP:	1.57730

Publication Number	Title	Priority Date
CN-112961054-A	Method for iron-catalyzed ethoxycarbonyl difluoromethylation of aromatic compound	20210219
CN-112851670-A	Simple synthesis method of 3-polyfluoroalkyl substituted imidazo [1,2-a ] pyridine	20210119
CN-112552342-A	Difluoroalkyl-containing tetra-substituted alkenyl phosphine oxide compound and preparation method thereof	20201207
CN-112279754-A	Preparation method of beta-caryophyllene derived difluoroalkyl substituted tricyclic compound	20201104
CN-112047839-A	1-iodine-3-perfluoroalkyl alkene compound and preparation method thereof	20200811

PMID	Publication Date	Title	Journal
22421710	20120428	Enantioselective Reformatsky reaction of ethyl iododifluoroacetate with ketones	Organic & biomolecular chemistry

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[59855-96-8]
2-(Methoxymethyl)thiazole-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:	115
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	249.93023
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	249.93023
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5