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1-(3-Fluoro-4-methoxyphenyl)cyclopropanecarboxylic Acid

1-(3-Fluoro-4-methoxyphenyl)cyclopropanecarboxylic Acid - CAS 936728-02-8

Catalog:	BB041014
Product Name:	1-(3-Fluoro-4-methoxyphenyl)cyclopropanecarboxylic Acid
CAS:	936728-02-8
Synonyms:	1-(3-fluoro-4-methoxyphenyl)-1-cyclopropanecarboxylic acid; 1-(3-fluoro-4-methoxyphenyl)cyclopropane-1-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	1-(3-fluoro-4-methoxyphenyl)cyclopropane-1-carboxylic acid
Description:	1-(3-Fluoro-4-methoxyphenyl)cyclopropanecarboxylic Acid (CAS# 936728-02-8) is a useful research chemical.
Molecular Weight:	210.20
Molecular Formula:	C11H11FO3
Canonical SMILES:	COC1=C(C=C(C=C1)C2(CC2)C(=O)O)F
InChI:	InChI=1S/C11H11FO3/c1-15-9-3-2-7(6-8(9)12)11(4-5-11)10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)
InChI Key:	JKIHCIJMQGMLOG-UHFFFAOYSA-N

Publication Number	Title	Priority Date
TW-201738203-A	Tertiary guanamine and method of use	20160406
US-2019119200-A1	Tertiary amides and method of use	20160406
WO-2017177004-A1	Tertiary amides and method of use	20160406
US-2011098311-A1	Compositions for treatment of cystic fibrosis and other chronic diseases	20091022
US-2014121208-A1	Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases	20091022

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Complexity:	263
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.06922237
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	210.06922237
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8