Methyl 2,3,4,5-Tetrafluorobenzoate - CAS 5292-42-2

Catalog:	BB027984
Product Name:	Methyl 2,3,4,5-Tetrafluorobenzoate
CAS:	5292-42-2
Synonyms:	2,3,4,5-tetrafluorobenzoic acid methyl ester; methyl 2,3,4,5-tetrafluorobenzoate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2,3,4,5-tetrafluorobenzoate
Description:	Methyl 2,3,4,5-Tetrafluorobenzoate (CAS# 5292-42-2) is a useful research chemical.
Molecular Weight:	208.11
Molecular Formula:	C8H4F4O2
Canonical SMILES:	COC(=O)C1=CC(=C(C(=C1F)F)F)F
InChI:	InChI=1S/C8H4F4O2/c1-14-8(13)3-2-4(9)6(11)7(12)5(3)10/h2H,1H3
InChI Key:	MAEQYZYOSFAUAF-UHFFFAOYSA-N
Boiling Point:	220.3 °C at 760 mmHg
Density:	1.443 g/cm³
MDL:	MFCD06203829
LogP:	2.02960

Publication Number	Title	Priority Date
WO-2021023154-A1	Tetracyclic compound, preparation method therefor and use thereof	20190802
CN-109293478-B	Method for preparing tetrafluorobenzyl alcohol	20181102
AU-2014347029-A1	Method and composition for hydraulic fracturing and for tracing petroleum production	20131105
CA-2929773-A1	Method and composition for hydraulic fracturing and for tracing petroleum production	20131105
CN-105849366-A	Method and composition for hydraulic fracturing and fr tracing petroleum production	20131105

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Related Functional Groups

Carbonyl Compounds

[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
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.01474201
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	208.01474201
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2