2,3-Difluorobenzyl bromide - CAS 113211-94-2

Name: 2,3-Difluorobenzyl bromide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB003143
Product Name:	2,3-Difluorobenzyl bromide
CAS:	113211-94-2
Synonyms:	1-(bromomethyl)-2,3-difluorobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(bromomethyl)-2,3-difluorobenzene
Description:	2,3-Difluorobenzyl bromide (CAS# 113211-94-2) is a useful research chemical.
Molecular Weight:	207.02
Molecular Formula:	C7H5BrF2
Canonical SMILES:	C1=CC(=C(C(=C1)F)F)CBr
InChI:	InChI=1S/C7H5BrF2/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2
InChI Key:	FTBSGSZZESQDBM-UHFFFAOYSA-N
Boiling Point:	190.5 °C at 760 mmHg
Purity:	97 %
Density:	1.625 g/cm³
Appearance:	Clear colorless to light yellow liquid
Storage:	Inert atmosphere, 2-8 °C
MDL:	MFCD00042488
LogP:	2.85970

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Related Functional Groups

Fluorinated Building Blocks

[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[35989-28-7]C7H3Cl2FO2
2,5-Dichloro-4-fluorobenzoic acid
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[2091593-59-6]C9H10F3NO
3-methoxy-6-methyl-2-(trifluoromethyl)aniline
[1975118-13-8]C11H11F2N3
4-[3-(Difluoromethyl)-4-methyl-1H-pyrazol-1-yl]aniline

Halides

[1225940-17-9]C11H9ClF3N3
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[1855911-19-1]C7H13BrClN3
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[1936054-65-7]C11H9Cl2N
2,4-Dichloro-3,6-dimethylquinoline

Other Pyrimidines

[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[1632145-37-9]0
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione
[81290-20-2]C4H9F3Si
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

Publication Number	Title	Priority Date
KR-20210085369-A	1,2,3-Triazole Derivative Compounds as HSP90 Inhibitor, and the Use Thereof	20191230
WO-2021137665-A1	1, 2, 3-triazole derivative compound as hsp90 inhibitor, and use thereof	20191230
CN-112898292-A	Novel aurora kinase inhibitor and use thereof	20191203
WO-2021110009-A1	Novel aurora kinase inhibitor and use thereof	20191203
CN-110642918-A	Diosgenin derivative and preparation method and application thereof	20191012

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.95427
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	205.95427
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7