2-Bromo-5-fluorophenol - CAS 147460-41-1

Name: 2-Bromo-5-fluorophenol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB010199
Product Name:	2-Bromo-5-fluorophenol
CAS:	147460-41-1
Synonyms:	Phenol, 2-bromo-5-fluoro-

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromo-5-fluorophenol
Molecular Weight:	191.00
Molecular Formula:	C6H4BrFO
Canonical SMILES:	C1=CC(=C(C=C1F)O)Br
InChI:	InChI=1S/C6H4BrFO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H
InChI Key:	HUVAOAVBKOVPBZ-UHFFFAOYSA-N
Boiling Point:	194.6±20.0°C at 760 mmHg
Melting Point:	185 °C
Purity:	95%
Density:	1.764±0.06 g/cm3
Appearance:	Clear Colorless to Light Yellow Liquid
Storage:	Store at RT
MDL:	MFCD00040939
LogP:	2.29380

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Related Functional Groups

Fluorinated Building Blocks

[1820736-42-2]C11H11ClF3N3
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[2454490-85-6]C16H17BF2O2
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[452-76-6]C7H6F2
2,4-Difluorotoluene
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine

Other Pyrimidines

[452-76-6]C7H6F2
2,4-Difluorotoluene
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[2696462-69-6]C14H23N5O2Si
4-(4-Aminopyrimidin-2-yl)-2-methyl-1-(2-trimethylsilylethoxymethyl)pyrazol-3-one
[81290-20-2]C4H9F3Si
Trimethyl(trifluoromethyl)silane
[1489-53-8]C6H3F3
1,2,3-Trifluorobenzene

Oxygen Compounds

[52378-69-5]C13H19O3P
Diethyl trans-cinnamylphosphonate
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[832740-55-3]C16H15ClO3
3-[(4-Chloro-2-methylphenoxy)methyl]-4-methoxybenzaldehyde
[24550-39-8]C14H11ClO2
3-[(4-Chlorobenzyl)oxy]benzaldehyde

GHS Hazard Statement:	H302 (14.58%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021106230-A1	Novel phenol compound or salt thereof	20191129
WO-2021108023-A1	Penicillin-binding protein inhibitors	20191126
WO-2021032074-A1	Benzamide fused aromatic ring derivative, preparation method therefor and application thereof in medicine	20190819
CN-112390745-A	Pyridine nicotinamide derivatives, preparation method and medical application thereof	20190819
WO-2021018165-A1	Pyridine benzamide derivative, preparation method for same, and medicinal applications thereof	20190730

Complexity:	99.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.94296
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	189.94296
Rotatable Bond Count:	0
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6