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α-Methoxy-α-(trifluoromethyl)phenylacetic acid

α-Methoxy-α-(trifluoromethyl)phenylacetic acid - CAS 56135-03-6

Catalog:	BB029270
Product Name:	α-Methoxy-α-(trifluoromethyl)phenylacetic acid
CAS:	56135-03-6
Synonyms:	3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid

Technical Data

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Computed Properties

IUPAC Name:	3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid
Description:	α-Methoxy-α-(trifluoromethyl)phenylacetic acid (CAS# 56135-03-6 ) is a useful research chemical.
Molecular Weight:	234.17
Molecular Formula:	C10H9F3O3
Canonical SMILES:	COC(C1=CC=CC=C1)(C(=O)O)C(F)(F)F
InChI:	InChI=1S/C10H9F3O3/c1-16-9(8(14)15,10(11,12)13)7-5-3-2-4-6-7/h2-6H,1H3,(H,14,15)
InChI Key:	JJYKJUXBWFATTE-UHFFFAOYSA-N
Boiling Point:	95-98 °C0.05 mmHg (lit.)
Melting Point:	41-46 °C(lit.)
Purity:	95 %
Storage:	2-8 °C
LogP:	2.17520

Publication Number	Title	Priority Date
CN-113512010-A	Photosensitizer with AIE characteristic and capable of overcoming hypoxia, and preparation method and application thereof	20210720
CN-113437912-A	Prediction control method and system for strong robustness model of permanent magnet synchronous motor	20210709
CN-113381635-A	Traction converter thermal performance dynamic optimization control method and system	20210629
CN-113515059-A	RT-LAB-based multi-electric aircraft motor controller time-sharing multiplexing semi-physical test system	20210627
CN-113295999-A	Demagnetization, winding open circuit and turn-to-turn short circuit fault classification method for permanent magnet synchronous motor	20210624

PMID	Publication Date	Title	Journal
22847388	20120720	A faster, high resolution, mtPA-GFP-based mitochondrial fusion assay acquiring kinetic data of multiple cells in parallel using confocal microscopy	Journal of visualized experiments : JoVE
22253063	20120301	First isolation of disubstituted cis-5,6-dihydro-1,10-phenanthrolines. Lipase-mediated resolution of cis- and trans-phenoxy alcohol isomers and assignment of absolute stereochemistry via CD and NMR spectroscopy	Chirality
22201421	20120120	Bicunningines A and B, two new dimeric diterpenes from Cunninghamia lanceolata	Organic letters
22363239	20111201	Inhibition of virulence gene expression in Staphylococcus aureus by novel depsipeptides from a marine photobacterium	Marine drugs
21808807	20111007	Optimizing dirhodium(II) tetrakiscarboxylates as chiral NMR auxiliaries	Organic & biomolecular chemistry

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	259
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:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3