7-Bromo-2-methylbenzofuran - CAS 57547-15-6

Catalog:	BB029747
Product Name:	7-Bromo-2-methylbenzofuran
CAS:	57547-15-6
Synonyms:	7-bromo-2-methylbenzofuran; 7-bromo-2-methyl-1-benzofuran

Technical Data

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Computed Properties

IUPAC Name:	7-bromo-2-methyl-1-benzofuran
Description:	7-Bromo-2-methylbenzofuran (CAS# 57547-15-6 ) is a useful research chemical.
Molecular Weight:	211.06
Molecular Formula:	C9H7BrO
Canonical SMILES:	CC1=CC2=C(O1)C(=CC=C2)Br
InChI:	InChI=1S/C9H7BrO/c1-6-5-7-3-2-4-8(10)9(7)11-6/h2-5H,1H3
InChI Key:	RLVGRFODLCTVTN-UHFFFAOYSA-N
LogP:	3.50370

Publication Number	Title	Priority Date
WO-2021123372-A1	Novel compounds and their use	20191219
WO-2020099341-A1	Antibiotic compounds, methods of manufacturing the same, pharmaceutical compositions containing the same and uses thereof	20181112
CN-113272302-A	Antibiotic compounds, process for their manufacture, pharmaceutical compositions containing them and their use	20181112
EP-3880675-A1	Antibiotic compounds, methods of manufacturing the same, pharmaceutical compositions containing the same and uses thereof	20181112
KR-20210093292-A	Antibiotic compound, preparation method thereof, pharmaceutical composition comprising same, and use thereof	20181112

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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:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.96803
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	209.96803
Rotatable Bond Count:	0
Topological Polar Surface Area:	13.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4