2-Fluoro-5-(trifluoromethyl)benzoyl chloride - CAS 207981-46-2

Name: 2-Fluoro-5-(trifluoromethyl)benzoyl chloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB016308
Product Name:	2-Fluoro-5-(trifluoromethyl)benzoyl chloride
CAS:	207981-46-2
Synonyms:	2-fluoro-5-(trifluoromethyl)benzoyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-fluoro-5-(trifluoromethyl)benzoyl chloride
Description:	2-Fluoro-5-(trifluoromethyl)benzoyl chloride (CAS# 207981-46-2) is a useful research chemical.
Molecular Weight:	226.56
Molecular Formula:	C8H3ClF4O
Canonical SMILES:	C1=CC(=C(C=C1C(F)(F)F)C(=O)Cl)F
InChI:	InChI=1S/C8H3ClF4O/c9-7(14)5-3-4(8(11,12)13)1-2-6(5)10/h1-3H
InChI Key:	OFVKAIZITGCCDN-UHFFFAOYSA-N
Boiling Point:	191.2 °C at 760 mmHg
Purity:	97 %
Density:	1.5 g/cm³
MDL:	MFCD00061156
LogP:	3.22350

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Related Functional Groups

Carbonyl Compounds

[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

Fluorinated Building Blocks

[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
[35989-28-7]C7H3Cl2FO2
2,5-Dichloro-4-fluorobenzoic acid
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid

Other Pyrimidines

[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[832739-73-8]C10H6Cl2N2S
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[77776-68-2]C6HCl3N4
2,4,8-Trichloropyrimido[5,4-d]pyrimidine
[246847-98-3]C5H4ClFN2
2-Amino-5-chloro-3-fluoropyridine

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2020140959-A1	6-oxo-1,6-dihydropyridazine derivative, preparation method therefor and medical use thereof	20190104
TW-202039443-A	6-oxo-1,6-dihydropyridazin derivative, a preparation method thereof and a medical use thereof	20190104
CN-112955436-A	6-oxo-1, 6-dihydropyridazine derivatives, preparation method and application thereof in medicines	20190104
KR-20210112336-A	6-oxo-1,6-dihydropyridazine derivatives, methods for their preparation, and medicinal uses thereof	20190104
CN-107892689-A	One kind cyclisation berberinc derivate and its production and use	20171128

Complexity:	228
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	225.9808551
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	225.9808551
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4