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2-Bromo-7-(trifluoromethyl)naphthalene

2-Bromo-7-(trifluoromethyl)naphthalene - CAS 853017-61-5

Catalog:	BB037584
Product Name:	2-Bromo-7-(trifluoromethyl)naphthalene
CAS:	853017-61-5
Synonyms:	2-bromo-7-(trifluoromethyl)naphthalene; 2-bromo-7-(trifluoromethyl)naphthalene

Technical Data

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Computed Properties

IUPAC Name:	2-bromo-7-(trifluoromethyl)naphthalene
Description:	2-Bromo-7-(trifluoromethyl)naphthalene (CAS# 853017-61-5 ) is a useful research chemical.
Molecular Weight:	275.06
Molecular Formula:	C11H6BrF3
Canonical SMILES:	C1=CC(=CC2=C1C=CC(=C2)Br)C(F)(F)F
InChI:	InChI=1S/C11H6BrF3/c12-10-4-2-7-1-3-9(11(13,14)15)5-8(7)6-10/h1-6H
InChI Key:	QFIKEQGSVOITBU-UHFFFAOYSA-N
LogP:	4.62110

Publication Number	Title	Priority Date
AU-2005305072-A1	Niacin receptor agonists, compositions containing such compounds and methods of treatment	20041104
CA-2586156-A1	Niacin receptor agonists, compositions containing such compounds and methods of treatment	20041104
CN-101056635-A	Niacin receptor agonists, compositions containing such compounds and methods of treatment	20041104
EP-1809284-A2	Niacin receptor agonists, compositions containing such compounds and methods of treatment	20041104
EP-1809284-A4	NIACIN RECEPTOR AGONISTS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND METHODS OF TREATING THE SAME	20041104

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Complexity:	226
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	273.9605
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	273.9605
Rotatable Bond Count:	0
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.7