Ethyl chlorofluoroacetate - CAS 401-56-9

Name: Ethyl chlorofluoroacetate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024338
Product Name:	Ethyl chlorofluoroacetate
CAS:	401-56-9
Synonyms:	ethyl 2-chloro-2-fluoroacetate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 2-chloro-2-fluoroacetate
Description:	Ethyl Chlorofluoroacetate (CAS# 401-56-9) can be used as an inorganic nanomaterial-based printing ink for electroluminescent diode display and also for automotive window coating.
Molecular Weight:	140.54
Molecular Formula:	C4H6ClFO2
Canonical SMILES:	CCOC(=O)C(F)Cl
InChI:	InChI=1S/C4H6ClFO2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3
InChI Key:	WUHVJSONZHSDFC-UHFFFAOYSA-N
Boiling Point:	128-130 °C
Purity:	95 %
Density:	1.22 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00039333
LogP:	1.08390

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[17432-37-0]C11H14O
2,3,5,6-Tetramethylbenzaldehyde

Fluorinated Building Blocks

[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1106917-71-8]C8H10ClF2NO
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[1011396-69-2]C12H17F2NO2
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[151585-93-2]C7H6FNO
2-Amino-6-fluorobenzaldehyde
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid

Other Pyrimidines

[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[4318-56-3]C5H5ClN2O2
6-Chloro 3-Methyl Uracil
[207605-39-8]C8H2F5NO2
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[1160246-50-3]C14H14F3N3O
2-((4-(P-Tolyl)-6-(trifluoromethyl)pyrimidin-2-yl)oxy)ethanamine

GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]; H302 (13.64%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (13.64%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H332 (13.64%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021030711-A1	Alkynyl quinazoline compounds	20190815
WO-2020073031-A1	Fused bicyclic heterocycles as thereapeutic agents	20181005
EP-3856735-A1	Fused bicyclic heterocycles as thereapeutic agents	20181005
DE-102015116389-A1	Organic electronic device with carrier generation layer and use of a zinc complex as a p-type dopant in carrier generation layers	20150928
EP-3322702-A1	Cyanopyrrolidines as dub inhibitors for the treatment of cancer	20150714

Complexity:	86.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.0040353
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	140.0040353
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1