Bis(2,2,2-trifluoroethyl) ether - CAS 333-36-8

Catalog:	BB021672
Product Name:	Bis(2,2,2-trifluoroethyl) ether
CAS:	333-36-8
Synonyms:	1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)ethane

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Computed Properties

IUPAC Name:	1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)ethane
Description:	Bis(2,2,2-trifluoroethyl) ether (CAS# 333-36-8) is Prophylactic and/or therapeutic agent for Alzheimer's disease.
Molecular Weight:	182.06
Molecular Formula:	C4H4F6O
Canonical SMILES:	C(C(F)(F)F)OCC(F)(F)F
InChI:	InChI=1S/C4H4F6O/c5-3(6,7)1-11-2-4(8,9)10/h1-2H2
InChI Key:	KGPPDNUWZNWPSI-UHFFFAOYSA-N
Boiling Point:	63.9 ℃ at 760 mmHg
Melting Point:	122.5-123
Purity:	95 %
Density:	1.404 g/cm³
Appearance:	Colorless liquid
Storage:	Flammables area
MDL:	MFCD00010604
LogP:	2.12760

Publication Number	Title	Priority Date
CN-113363586-A	Lithium battery electrolyte and application thereof in lithium battery	20210628
CN-113437251-A	Negative electrode active material, electrochemical device, and electronic device	20210621
CN-113024643-A	Artificial peptidomimetic and preparation method and application thereof	20210430
CN-113206296-A	Electrolyte solution, electrochemical device, and electronic device	20210430
CN-113224386-A	Cobalt acid lithium battery electrolyte additive, electrolyte and battery thereof	20210430

PMID	Publication Date	Title	Journal
23769903	20130905	FDA-approved drugs and other compounds tested as inhibitors of human glutathione transferase P1-1	Chemico-biological interactions
22580101	20120801	Effects of enriched environment in spatial learning and memory of immature rats submitted to early undernourish and seizures	International journal of developmental neuroscience : the official journal of the International Society for Developmental Neuroscience
22260920	20120501	Triheptanoin in acute mouse seizure models	Epilepsy research
22442080	20120321	Repetitive convulsant-induced seizures reduce the number but not precision of hippocampal place cells	The Journal of neuroscience : the official journal of the Society for Neuroscience
22341963	20120301	An isolated epileptic seizure elicits learning impairment which could be prevented by melatonin	Epilepsy & behavior : E&B

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GHS Hazard Statement:	H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	98.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	182.01663372
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	182.01663372
Rotatable Bond Count:	2
Topological Polar Surface Area:	9.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3