2,3,5,6-Tetrafluoro-4-methylbenzyl Alcohol - CAS 79538-03-7

Catalog:	BB036371
Product Name:	2,3,5,6-Tetrafluoro-4-methylbenzyl Alcohol
CAS:	79538-03-7
Synonyms:	(2,3,5,6-tetrafluoro-4-methylphenyl)methanol; (2,3,5,6-tetrafluoro-4-methylphenyl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(2,3,5,6-tetrafluoro-4-methylphenyl)methanol
Description:	2,3,5,6-Tetrafluoro-4-methylbenzyl Alcohol (CAS# 79538-03-7) is a useful research chemical.
Molecular Weight:	194.13
Molecular Formula:	C8H6F4O
Canonical SMILES:	CC1=C(C(=C(C(=C1F)F)CO)F)F
InChI:	InChI=1S/C8H6F4O/c1-3-5(9)7(11)4(2-13)8(12)6(3)10/h13H,2H2,1H3
InChI Key:	PJCSTULKVNHEGW-UHFFFAOYSA-N
Boiling Point:	201.4 °C at 760 mmHg
Density:	1.423 g/cm³
Appearance:	Almost white powder
MDL:	MFCD03093260
LogP:	2.04370

Publication Number	Title	Priority Date
CN-111620760-A	Method for preparing 2,3,5, 6-tetrachlorobenzonitrile, special catalyst and preparation method	20200422
JP-2020200258-A	Ester compounds and their uses	20190607
CN-109776327-A	First chlorine chrysanthemumic acid polyfluoro benzylalcohol chrysanthemum ester type compound, preparation method and application	20190227
JP-2021516255-A	Method for Synthesis of 4-Methoxymethyl-2,3,5,6-Tetrafluorobenzene Methanol	20181221
CN-108435165-B	Preparation method, preservation method and application of rhodium-palladium alloy	20180212

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Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.03547746
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	194.03547746
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8