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3-(Dimethylamino)-1-(4-fluorophenyl)-2-propen-1-one

3-(Dimethylamino)-1-(4-fluorophenyl)-2-propen-1-one - CAS 75175-77-8

Catalog:	BB035259
Product Name:	3-(Dimethylamino)-1-(4-fluorophenyl)-2-propen-1-one
CAS:	75175-77-8
Synonyms:	(E)-3-(dimethylamino)-1-(4-fluorophenyl)-2-propen-1-one; (E)-3-(dimethylamino)-1-(4-fluorophenyl)prop-2-en-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	(E)-3-(dimethylamino)-1-(4-fluorophenyl)prop-2-en-1-one
Description:	3-(Dimethylamino)-1-(4-fluorophenyl)-2-propen-1-one (CAS# 75175-77-8) is a useful research chemical.
Molecular Weight:	193.22
Molecular Formula:	C11H12FNO
Canonical SMILES:	CN(C)C=CC(=O)C1=CC=C(C=C1)F
InChI:	InChI=1S/C11H12FNO/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-8H,1-2H3/b8-7+
InChI Key:	GTJNUCRUOWBWEW-BQYQJAHWSA-N
MDL:	MFCD00111509
LogP:	2.08370

Publication Number	Title	Priority Date
WO-2021113363-A1	Sstr5 antagonists	20191203
WO-2020250183-A1	Fused heterocyclic compounds and their use as pest control agents	20190613
WO-2020135210-A1	Substituted aryl compound and preparation method therefor and use thereof	20181228
AU-2017229129-A1	Thiazolidinone compounds and use thereof	20160307
EP-3426246-A1	Thiazolidinone compounds and use thereof	20160307

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Complexity:	217
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	193.090292168
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	193.090292168
Rotatable Bond Count:	3
Topological Polar Surface Area:	20.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1