PINACOLONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H12O
Molecular Weight	100.1589
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)C(C)(C)C

InChI

InChIKey=PJGSXYOJTGTZAV-UHFFFAOYSA-N

InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3

HIDE SMILES / InChI

Molecular Formula	C6H12O
Molecular Weight	100.1589
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Effect of meso-substituents on the osmium tetraoxide reaction and pinacol-pinacolone rearrangement of the corresponding vic-dihydroxyporphyrins.	2001 Jun 1	11375017
Palladium-catalyzed tandem reactions to form 1-vinyl-1h-isochromene derivatives.	2001 May 18	11348108
Multiplicity control in the polygeminal diazeniumdiolation of active hydrogen bearing carbons: chemistry of a new type of trianionic molecular propeller.	2001 Nov 7	11686687
Pinacol coupling reaction of beta-halo-alpha,beta-unsaturated aldehydes promoted by TiI4.	2002 Nov 14	12423095
Degradation of isooctane by Mycobacterium austroafricanum IFP 2173: growth and catabolic pathway.	2004	15281945
Enzymatic enantioselective transcyanation of silicon-containing aliphatic ketone with (S)-hydroxynitrile lyase from Manihot esculenta.	2004 Nov	15309340
Highly chemoselective oxidation of dithioester enethiolates to sulfenates: application to the synthesis of ketene dithioacetal s-oxides.	2004 Oct 1	15387625
Designing the "search pathway" in the development of a new class of highly efficient stereoselective hydrosilylation catalysts.	2005 Apr 22	15744702
A RuH(2)(CO)(PPh(3))(3)-catalyzed regioselective arylation of aromatic ketones with arylboronates via carbon-hydrogen bond cleavage.	2005 Apr 27	15839693
Coupling of an aldehyde or ketone to pyridine mediated by a tungsten imido complex.	2005 Dec 12	16323938
Synthesis of 2H-1,2-benzothiazine 1,1-dioxides via heteroannulation reactions of 2-iodobenzenesulfonamide with ketone enolates under S(RN)1 conditions.	2005 Nov 11	16268584
Coupling of enantioselective biooxidation of DL-1,2-propanediol and bioreduction of pinacolone via regeneration cycle of coenzyme.	2006 Aug	16489454
1-(4-Chloro-phen-yl)-4,4-dimethyl-pent-1-en-3-one.	2009 Feb 28	21582301
Solvent-washable polymer templated synthesis of mesoporous materials and solid-acid nanocatalysts in one-pot.	2009 Nov 7	19826668
Calyculins and related marine natural products as serine-threonine protein phosphatase PP1 and PP2A inhibitors and total syntheses of calyculin A, B, and C.	2010 Jan 21	20161975
Direct conversion of arylamines to pinacol boronates: a metal-free borylation process.	2010 Mar 1	20127778

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:35:16 UTC 2023` Edited by `admin` on `Fri Dec 15 19:35:16 UTC 2023`
Record UNII	3U1AAG3528
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PINACOLONE

Systematic Name

English

PINACOLONE [MI]

Common Name

English

3,3-DIMETHYL-2-BUTANONE

Systematic Name

English

NSC-935

Code

English

3,3-DIMETHYL-2-BUTANONE [HSDB]

Common Name

English

TERT-BUTYL METHYL KETONE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

200-920-4