2-Fluoro-3-(trifluoromethyl)benzyl bromide - CAS 184970-25-0

Catalog:	BB014172
Product Name:	2-Fluoro-3-(trifluoromethyl)benzyl bromide
CAS:	184970-25-0
Synonyms:	1-(bromomethyl)-2-fluoro-3-(trifluoromethyl)benzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(bromomethyl)-2-fluoro-3-(trifluoromethyl)benzene
Description:	2-Fluoro-3-(trifluoromethyl)benzyl bromide (CAS# 184970-25-0) is a useful research chemical.
Molecular Weight:	257.02
Molecular Formula:	C8H5BrF4
Canonical SMILES:	C1=CC(=C(C(=C1)C(F)(F)F)F)CBr
InChI:	InChI=1S/C8H5BrF4/c9-4-5-2-1-3-6(7(5)10)8(11,12)13/h1-3H,4H2
InChI Key:	QBEHXDXQUVMEQX-UHFFFAOYSA-N
Boiling Point:	199.4 °C at 760 mmHg
Melting Point:	58-62 °C
Purity:	95 %
Density:	1.64 g/cm³
Appearance:	White to light yellow crystal powder
MDL:	MFCD00061172
LogP:	3.73940

Publication Number	Title	Priority Date
KR-20210076693-A	Fused pyrimidine derivatives substituted with a nitrogen-containing heterocyclic ring and their pharmaceutical use	20191216
WO-2020243027-A1	Compounds, compositions, and methods of use	20190524
CN-109776553-B	Fuhexine and preparation method and application thereof	20190115
CN-109678871-B	Method for preparing bisbenzylisoquinoline compounds	20190115
CN-112041296-A	Aminoacetamides containing benzo-oxy-alicyclic structure and use thereof	20180428

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Related Functional Groups

Fluorinated Building Blocks

[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Halides

[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[444581-46-8]
1-Bromo-2-(1,1-difluoroethyl)benzene
[111-85-3]
1-Chlorooctane
[856848-33-4]
2-Amino-4,5-dibromopyridine

Other Pyrimidines

[1597-32-6]
2-Amino-6-fluoropyridine
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[451-46-7]
Ethyl 4-fluorobenzoate
[81290-20-2]
Trimethyl(trifluoromethyl)silane

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

Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	255.95108
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	255.95108
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5