7-Bromo-5-fluorobenzofuran - CAS 253429-19-5

Catalog:	BB018869
Product Name:	7-Bromo-5-fluorobenzofuran
CAS:	253429-19-5
Synonyms:	7-bromo-5-fluorobenzofuran; 7-bromo-5-fluoro-1-benzofuran

Technical Data

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Computed Properties

IUPAC Name:	7-bromo-5-fluoro-1-benzofuran
Description:	7-Bromo-5-fluorobenzofuran (CAS# 253429-19-5) is a useful research chemical.
Molecular Weight:	215.02
Molecular Formula:	C8H4BrFO
Canonical SMILES:	C1=COC2=C(C=C(C=C21)F)Br
InChI:	InChI=1S/C8H4BrFO/c9-7-4-6(10)3-5-1-2-11-8(5)7/h1-4H
InChI Key:	TYBMMMOEVBNTDU-UHFFFAOYSA-N
Boiling Point:	233.4 °C at 760 mmHg
Density:	1.696 g/cm³
Appearance:	Colorless liquid
LogP:	3.33440

Publication Number	Title	Priority Date
AU-2017342156-A1	1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin D synthase inhibitors	20161013
CA-3038756-A1	1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin d synthase inhibitors	20161013
EP-3526206-A1	1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin d synthase inhibitors	20161013
JP-2019536757-A	1,3-Disubstituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin D synthase inhibitors	20161013
TW-201827412-A	Chemical compound	20161013

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Related Functional Groups

Benzofuran/Benzothiophene

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N-(9,9-Dimethyl-9H-fluoren-2-yl)dibenzo[b,d]furan-3-amine
N-(9,9-dimethylfluoren-2-yl)dibenzothiophen-2-amine
N-(9,9-diphenyl-9H-fluoren-2-yl)dibenzo[b,d]furan-3-amine
[926257-36-5]
4-Bromo-3-chloro-1-benzothiophene-2-carboxylic acid
[174186-43-7]
6,7,8,9-Tetrahydrodibenzo[b,d]furan-4-carboxylic acid

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GHS Hazard Statement:	H302 (100%): 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

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.94296
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	213.94296
Rotatable Bond Count:	0
Topological Polar Surface Area:	13.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1