3-Chloro-4'-fluoropropiophenone - CAS 347-93-3

Name: 3-Chloro-4'-fluoropropiophenone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB022289
Product Name:	3-Chloro-4'-fluoropropiophenone
CAS:	347-93-3
Synonyms:	3-chloro-1-(4-fluorophenyl)propan-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	3-chloro-1-(4-fluorophenyl)propan-1-one
Description:	3-Chloro-4'-fluoropropiophenone (CAS# 347-93-3) is a useful research chemical.
Molecular Weight:	186.61
Molecular Formula:	C9H8ClFO
Canonical SMILES:	C1=CC(=CC=C1C(=O)CCCl)F
InChI:	InChI=1S/C9H8ClFO/c10-6-5-9(12)7-1-3-8(11)4-2-7/h1-4H,5-6H2
InChI Key:	AAHQPLJUSLMHHR-UHFFFAOYSA-N
Boiling Point:	100-103 °C
Density:	1.219 g/cm³
MDL:	MFCD00000991
LogP:	2.63730

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

Fluorinated Building Blocks

[1427357-61-6]C6H4FN3
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[2454490-85-6]C16H17BF2O2
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[151585-93-2]C7H6FNO
2-Amino-6-fluorobenzaldehyde

Other Pyrimidines

[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[860790-29-0]C11H15F3N4
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
[77776-68-2]C6HCl3N4
2,4,8-Trichloropyrimido[5,4-d]pyrimidine
[246847-98-3]C5H4ClFN2
2-Amino-5-chloro-3-fluoropyridine
[672-45-7]C5H3F3N2O2
6-(Trifluoromethyl)uracil

Publication Number	Title	Priority Date
EP-3569592-A1	Hdac6 selective inhibitors, preparation method therefor, and application thereof	20170110
US-2018353480-A1	Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (ripk1)	20151204
WO-2017096301-A1	Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (ripk 1)	20151204
US-10709692-B2	Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1)	20151204
US-2016176868-A1	Bicyclic-pyrimidinedione compounds	20141218

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.0247707
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	186.0247707
Rotatable Bond Count:	3
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2