Tetrafluoroterephthalonitrile - CAS 1835-49-0

Catalog:	BB014065
Product Name:	Tetrafluoroterephthalonitrile
CAS:	1835-49-0
Synonyms:	2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile
Description:	Tetrafluoroterephthalonitrile (CAS# 1835-49-0) is a useful research chemical.
Molecular Weight:	200.09
Molecular Formula:	C8F4N2
Canonical SMILES:	C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F
InChI:	InChI=1S/C8F4N2/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11
InChI Key:	PCRSJGWFEMHHEW-UHFFFAOYSA-N
Boiling Point:	243.3 °C at 760 mmHg
Density:	1.54 g/cm³
Appearance:	White to yellow to yellow-green powder or crystals
MDL:	MFCD00001776
LogP:	1.98636

Publication Number	Title	Priority Date
CN-113429765-A	Degradable PLA/PIM-1 air-conditioning film and preparation method and application thereof	20210616
CN-113307990-A	Composite material and preparation method and application thereof	20210609
CN-113289589-A	Benzene ring modified beta-cyclodextrin gel adsorbent, preparation method and application thereof	20210528
CN-113299971-A	Lithium ion battery and application thereof	20210520
CN-113299972-A	Lithium ion battery and application thereof	20210520

PMID	Publication Date	Title	Journal
21706644	20090420	Copolymers of Intrinsic Microporosity Based on 2,2',3,3'-Tetrahydroxy-1,1'-dinaphthyl	Macromolecular rapid communications
14581753	20031101	Simultaneous variation of multipole parameters and Gram-Charlier coefficients in a charge-density study of tetrafluoroterephthalonitrile based on X-ray and neutron data	Acta crystallographica. Section A, Foundations of crystallography
14558834	20031022	Selective oxygenation of ring-substituted toluenes with electron-donating and -withdrawing substituents by molecular oxygen via photoinduced electron transfer	Journal of the American Chemical Society

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Related Functional Groups

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1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1018125-51-3]
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[459836-92-1]
3,6-Difluoro-2-methylbenzoic acid
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine

Nitrogen Compounds

[32894-07-8]
Benzyl thioacetimidate hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

Other Pyrimidines

[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[1597-32-6]
2-Amino-6-fluoropyridine
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[451-46-7]
Ethyl 4-fluorobenzoate
[207605-39-8]
trans-2,3,4,5,6-Pentafluoro-β-nitrostyrene
[1489-53-8]
1,2,3-Trifluorobenzene

GHS Hazard Statement:	H301 (97.62%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	266
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.99976066
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	199.99976066
Rotatable Bond Count:	0
Topological Polar Surface Area:	47.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8