Di-3-thienyl ketone - CAS 26453-81-6

Catalog:	BB019288
Product Name:	Di-3-thienyl ketone
CAS:	26453-81-6
Synonyms:	di(thiophen-3-yl)methanone

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Computed Properties

IUPAC Name:	di(thiophen-3-yl)methanone
Description:	Di-3-thienyl ketone (CAS# 26453-81-6 ) is a useful research chemical.
Molecular Weight:	194.27
Molecular Formula:	C9H6OS2
Canonical SMILES:	C1=CSC=C1C(=O)C2=CSC=C2
InChI:	InChI=1S/C9H6OS2/c10-9(7-1-3-11-5-7)8-2-4-12-6-8/h1-6H
InChI Key:	RMMZGPSYPUIIRO-UHFFFAOYSA-N
LogP:	3.04060

Publication Number	Title	Priority Date
WO-2020204733-A1	A solvent drying composition and processes therfor	20190403
TW-202104480-A	A solvent drying composition and processes therfor	20190403
CN-109836410-A	One kind (4,6- diaryl -3,4- dihydro -2H- sulphur pyrans -3- base)-aryl ketone and preparation	20190402
CN-110240592-A	(Z) -3- (3- formoxyl benzylidene) piperazinedione compounds and its application in preparation of anti-tumor drugs	20180308
AU-2018346086-A1	A salt recovery solution and processes of use thereof	20171003

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	193.98600716
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	193.98600716
Rotatable Bond Count:	2
Topological Polar Surface Area:	73.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6