2,3,5,6-Tetrafluorobenzaldehyde - CAS 19842-76-3

Catalog:	BB015344
Product Name:	2,3,5,6-Tetrafluorobenzaldehyde
CAS:	19842-76-3
Synonyms:	2,3,5,6-tetrafluorobenzaldehyde

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2,3,5,6-tetrafluorobenzaldehyde
Description:	2,3,5,6-Tetrafluorobenzaldehyde (CAS# 19842-76-3) is a useful research chemical.
Molecular Weight:	178.08
Molecular Formula:	C7H2F4O
Canonical SMILES:	C1=C(C(=C(C(=C1F)F)C=O)F)F
InChI:	InChI=1S/C7H2F4O/c8-4-1-5(9)7(11)3(2-12)6(4)10/h1-2H
InChI Key:	YIRYOMXPMOLQSO-UHFFFAOYSA-N
Boiling Point:	178 °C at 760 mmHg
Density:	1.525 g/cm³
Appearance:	Clear yellow liquid
MDL:	MFCD00167387
LogP:	2.05550

Publication Number	Title	Priority Date
CN-113292399-A	Synthetic method of transfluthrin intermediate	20210430
JP-2019172826-A	Fluorescent compound and fluorescently labeled biological material using the same	20180328
EP-3531132-A1	Kit for measuring substance to be measured, fluorescent labeling agent, and fluorescently labeled antibody	20180222
WO-2019163929-A1	Progesterone measurement kit, progesterone measurement method, and progesterone measurement reagent	20180222
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PMID	Publication Date	Title	Journal
16119190	20050601	Carbonic anhydrase inhibitors: Inhibition of the tumor-associated isozymes IX and XII with polyfluorinated aromatic/heterocyclic sulfonamides	Journal of enzyme inhibition and medicinal chemistry
15139757	20040520	Carbonic anhydrase inhibitors: synthesis and topical intraocular pressure lowering effects of fluorine-containing inhibitors devoid of enhanced reactivity	Journal of medicinal chemistry
15081039	20040503	Carbonic anhydrase inhibitors: inhibition of the tumor-associated isozyme IX with fluorine-containing sulfonamides. The first subnanomolar CA IX inhibitor discovered	Bioorganic & medicinal chemistry letters

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Related Functional Groups

Carbonyl Compounds

[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Fluorinated Building Blocks

[1427357-61-6]
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Other Pyrimidines

[937601-34-8]
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[13566-71-7]
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[451-46-7]
Ethyl 4-fluorobenzoate
[551-62-2]
1,2,3,4-Tetrafluorobenzene
[45867-11-6]
2-Amino-5-chloro-4-pyrimidinecarboxylic 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:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.00417733
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	178.00417733
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9