Ethyl (4-fluorobenzoyl)acetate - CAS 1999-00-4

Catalog:	BB015431
Product Name:	Ethyl (4-fluorobenzoyl)acetate
CAS:	1999-00-4
Synonyms:	ethyl 3-(4-fluorophenyl)-3-oxopropanoate

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	ethyl 3-(4-fluorophenyl)-3-oxopropanoate
Description:	Ethyl (4-fluorobenzoyl)acetate (CAS# 1999-00-4) is a useful research chemical.
Molecular Weight:	210.20
Molecular Formula:	C11H11FO3
Canonical SMILES:	CCOC(=O)CC(=O)C1=CC=C(C=C1)F
InChI:	InChI=1S/C11H11FO3/c1-2-15-11(14)7-10(13)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3
InChI Key:	SJUXLKYJKQBZLM-UHFFFAOYSA-N
Boiling Point:	117-120 °C
Purity:	95.0 % (HPLC)
Density:	1.174 g/cm³
MDL:	MFCD03093631
LogP:	1.96160

Publication Number	Title	Priority Date
CN-112778133-A	high-pH-value chrome tanning auxiliary agent containing polyfunctional group structure and preparation method and application thereof	20210107
WO-2021119343-A1	Compositions and methods for substituted 7-(piperazin-1-yl)pyrazolo[1,5-a]pyrimidine analogs as inhibitors of kras	20191210
CN-111072476-A	Î² -ketoester compound oxygen high-selectivity monofluoromethylation method	20191206
CN-110552018-A	Method for synthesizing 1-naphthol compound based on electrochemical intermolecular cyclization	20191017
CN-110552018-B	Method for synthesizing 1-naphthol compound based on electrochemical intermolecular cyclization	20191017

PMID	Publication Date	Title	Journal
22895969	20120815	Genital ulcer disease treatment for reducing sexual acquisition of HIV	The Cochrane database of systematic reviews
22837440	20120101	Mass spectrometic study of speciation in aluminium-fluoroquinolone solutions	European journal of mass spectrometry (Chichester, England)
21932848	20111019	Air- and heat-stable planar tri-p-quinodimethane with distinct biradical characteristics	Journal of the American Chemical Society
21717376	20110901	Photodegradation of fleroxacin injection: different products with different concentration levels	AAPS PharmSciTech
19428092	20091201	Synergistic antitumor effects of fleroxacin with 5-fluorouracil in vitro and in vivo for bladder cancer cell lines	Urology

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

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
[55441-25-3]
1-(2-Cyanophenyl)urea
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Fluorinated Building Blocks

[1427357-61-6]
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[452-76-6]
2,4-Difluorotoluene
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[151585-93-2]
2-Amino-6-fluorobenzaldehyde
[1795420-51-7]
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid

Other Pyrimidines

[452-76-6]
2,4-Difluorotoluene
[1597-32-6]
2-Amino-6-fluoropyridine
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[351-28-0]
3'-Fluoroacetanilide
[13566-71-7]
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[2696462-69-6]
4-(4-Aminopyrimidin-2-yl)-2-methyl-1-(2-trimethylsilylethoxymethyl)pyrazol-3-one

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:	232
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.06922237
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	210.06922237
Rotatable Bond Count:	5
Topological Polar Surface Area:	43.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2