1-(Trifluoroacetyl)-4-piperidinone - CAS 65220-86-2

Name: 1-(Trifluoroacetyl)-4-piperidinone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB032671
Product Name:	1-(Trifluoroacetyl)-4-piperidinone
CAS:	65220-86-2
Synonyms:	1-(2,2,2-trifluoroacetyl)piperidin-4-one

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2,2,2-trifluoroacetyl)piperidin-4-one
Description:	1-(Trifluoroacetyl)-4-piperidinone (CAS# 65220-86-2) is a useful research chemical.
Molecular Weight:	195.14
Molecular Formula:	C7H8F3NO2
Canonical SMILES:	C1CN(CCC1=O)C(=O)C(F)(F)F
InChI:	InChI=1S/C7H8F3NO2/c8-7(9,10)6(13)11-3-1-5(12)2-4-11/h1-4H2
InChI Key:	LUOSNGFOANFUES-UHFFFAOYSA-N
Boiling Point:	234.375 °C at 760 mmHg
Density:	1.378 g/cm³
Appearance:	Pale yellow to yellow brown solid
MDL:	MFCD09971275
LogP:	0.67810

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Related Functional Groups

Fluorinated Building Blocks

[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[2454490-85-6]C16H17BF2O2
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1011396-69-2]C12H17F2NO2
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Other Pyrimidines

[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[937601-34-8]C9H8BrN3O2
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

Publication Number	Title	Priority Date
US-2020071289-A1	Salts of an lsd1 inhibitor and processes for preparing the same	20180831
WO-2020047198-A1	Salts of an lsd1 inhibitor and processes for preparing the same	20180831
US-10968200-B2	Salts of an LSD1 inhibitor and processes for preparing the same	20180831
US-2021300891-A1	Salts of an lsd1 inhibitor and processes for preparing the same	20180831
CA-3027046-A1	Anti-cd98 antibodies and antibody drug conjugates	20160608

Complexity:	226
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	195.05071298
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	195.05071298
Rotatable Bond Count:	0
Topological Polar Surface Area:	37.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3