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3-[3-(Trifluoromethyl)phenoxy]propanoic Acid

3-[3-(Trifluoromethyl)phenoxy]propanoic Acid - CAS 111140-93-3

Catalog:	BB002721
Product Name:	3-[3-(Trifluoromethyl)phenoxy]propanoic Acid
CAS:	111140-93-3
Synonyms:	3-[3-(trifluoromethyl)phenoxy]propanoic acid; 3-[3-(trifluoromethyl)phenoxy]propanoic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	3-[3-(trifluoromethyl)phenoxy]propanoic acid
Description:	3-[3-(Trifluoromethyl)phenoxy]propanoic Acid (CAS# 111140-93-3 ) is a useful research chemical.
Molecular Weight:	234.17
Molecular Formula:	C10H9F3O3
Canonical SMILES:	C1=CC(=CC(=C1)OCCC(=O)O)C(F)(F)F
InChI:	InChI=1S/C10H9F3O3/c11-10(12,13)7-2-1-3-8(6-7)16-5-4-9(14)15/h1-3,6H,4-5H2,(H,14,15)
InChI Key:	PWGAEHHONPRIHO-UHFFFAOYSA-N
LogP:	2.55890

Publication Number	Title	Priority Date
EP-2714675-B1	4h-thieno[3,2-c]chromene-based inhibitors of notum pectinacetylesterase and methods of their use	20110527
US-2012302562-A1	4h-thieno[3,2-c]chromene-based inhibitors of notum pectinacetylesterase and methods of their use	20110527
US-2014256784-A1	4h-thieno[3,2-c]chromene-based inhibitors of notum pectinacetylesterase and methods of their use	20110527
US-9624238-B2	4H-thieno[3,2-C]chromene-based inhibitors of Notum Pectinacetylesterase and methods of their use	20110527
WO-2012166458-A1	4h-thieno[3,2-c]chromene-based inhibitors of notum pectinacetylesterase and methods of their use	20110527

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

Complexity:	240
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	234.05037863
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	234.05037863
Rotatable Bond Count:	4
Topological Polar Surface Area:	46.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3