PIVALDEHYDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H10O
Molecular Weight	86.1323
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)C=O

InChI

InChIKey=FJJYHTVHBVXEEQ-UHFFFAOYSA-N

InChI=1S/C5H10O/c1-5(2,3)4-6/h4H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C5H10O
Molecular Weight	86.1323
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
Kinetics and thermodynamics of H. transfer from (eta5-C5R5)Cr(CO)3H (R = Ph, Me, H) to methyl methacrylate and styrene.	2003 Aug 20	12914473
Migration of volatile degradation products into ozonated water from plastic packaging materials.	2003 Oct	14594682
Synthesis and biological evaluation of S-acyl-3-thiopropyl prodrugs of N-phosphonoacetyl-L-aspartate (PALA).	2003 Oct	14575935
Nucleophilic benzoylation using a mandelic acid dioxolanone as a synthetic equivalent of the benzoyl carbanion. Oxidative decarboxylation of alpha-hydroxyacids.	2004 Apr 30	18007437
Sugar bislactones by one-step oxidative dimerisation with pyridinium chlorochromate versus regioselective oxidation of vicinal diols.	2004 Aug 2	15261581
Rearrangement process occurring in the fragmentation of adefovir derivatives.	2004 Feb	14991683
Synthesis of 4,4-difluoroglycosides using ring-closing metathesis.	2004 Feb 21	14770232
Coordination modes vs. antitumor activity: synthesis and antitumor activity of novel platinum(II) complexes of N-substituted amino dicarboxylic acids.	2004 Jan	14659638
Carbocationic rearrangement of pivaloyl cation and protonated pivalaldehyde in superacid medium: a novel solution equivalent of the McLafferty rearrangement.	2004 Jul	15234354
Design, synthesis, and structure-activity relationship of new isobenzofuranone ligands of protein kinase C.	2004 Jun 7	15125969
Synthesis and biological evaluation in human monocyte-derived macrophages of N-(N-acetyl-L-cysteinyl)-S-acetylcysteamine analogues with potent antioxidant and anti-HIV activities.	2004 Mar 25	15027871
Phosphaalkynes from acid chlorides via P for O(Cl) metathesis: a recyclable niobium phosphide (P(3-)) reagent that effects C-P triple-bond formation.	2004 Nov 3	15506740
Highly diastereoselective arylation of (S)-mandelic acid enolate: enantioselective synthesis of substituted (R)-3-hydroxy-3-phenyloxindoles and (R)-benzylic acids and synthesis of nitrobenzophenones.	2004 Oct 1	15387607
Why does pivalaldehyde (trimethylacetaldehyde) unexpectedly seem more basic than 1-adamantanecarbaldehyde in the gas phase? FT-ICR and high-level ab initio studies.	2005 Mar 4	15669041
Synthesis of sterically crowded derivatives of anomeric pairs of D-glucose disaccharides.	2005 Sep 5	15996644
On the surface-catalyzed reaction between the gases 2,2-dimethylpropanal and methanamine. formation of active-site imines.	2006 Apr 28	16626124
Ligands with a 3,3-diphenylpentane skeleton for nuclear vitamin D and androgen receptors: Dual activities and metabolic activation.	2006 Aug 15	16698269
Mechanism of the gold(I)-catalyzed Rautenstrauch rearrangement: a center-to-helix-to-center chirality transfer.	2006 Feb 22	16478199
Possible mechanism for species difference on the toxicity of pivalic acid between dogs and rats.	2006 Jul 1	16430936
Improvement of proline enantioselective stationary phases by replacing the 9-fluorenylmethoxycarbonyl group.	2006 Mar 24	16483587
Formation of surface-bound acyl groups by reaction of acyl halides on ge(100)-2x1.	2006 Mar 9	16509705
Structural studies of model peptides containing beta-, gamma- and delta-amino acids.	2006 Nov 21	17312978
In vitro binding and functional studies of Ac-RYYRIK-ol and its derivatives, novel partial agonists of the nociceptin/orphanin F/Q receptor.	2006-2007	16874009
Reactive oxygen species generation through NADH oxidation by 6-formylpterin derivatives in the dark.	2007 Feb 23	17207775
Reaction of benzoxasilocines with aromatic aldehydes: Synthesis of homopterocarpans.	2007 Feb 8	17288601
5(6)-carboxyfluorescein revisited: new protecting group, separation of isomers, and their spectral properties on oligonucleotides.	2007 Sep-Oct	17696491
Electron-transfer-induced decomposition of 1,2-dioxetanes in negative-mode matrix- assisted laser desorption/ionization time-of-flight mass spectrometry.	2008	18401042
1,2-Bis[N'-(2,2-dimethyl-propionyl)thio-ureido]cyclo-hexa-ne.	2008 Apr 30	21202418
1,3-Bis[N-sulfonyl-(1R,2S)-1,3-diphenyl-2-aminopropanol]benzene: an excellent ligand for titanium-catalyzed asymmetric AlPh3(THF) additions to aldehydes.	2008 Aug	18537161
Acyl group migration and cleavage in selectively protected beta-d-galactopyranosides as studied by NMR spectroscopy and kinetic calculations.	2008 Jul 9	18543925
The Curtius rearrangement of cyclopropyl and cyclopropenoyl azides. A combined theoretical and experimental mechanistic study.	2008 Nov 7	18826325
Recent advances in pharmacotherapy of glaucoma.	2008 Oct	20040958
Stereoselective synthesis of enantiomerically pure nupharamine alkaloids from castoreum.	2009	19199304
DFP: a Bioconductor package for fuzzy profile identification and gene reduction of microarray data.	2009 Jan 29	19178723
(R)-Di-tert-butyl 1,1'-binaphthyl-2,2'-dicarboxyl-ate.	2009 Jan 8	21581860
1-(2-Chloro-5-nitro-phen-yl)-3-(2,2-di-methyl-propion-yl)thio-urea.	2009 Jul 1	21583450
Selective oxidation of tetralin over a chromium terephthalate metal organic framework, MIL-101.	2009 Jul 14	19662247
On the search for NNO-donor enantiopure scorpionate ligands and their coordination to group 4 metals.	2009 Jun 15	19441840
O-4-Chloro-benzoyl diphenyl-seleno-phosphinate.	2009 Mar 25	21582572
O-Pivaloyl diphenyl-seleno-phosphinate.	2009 Mar 25	21582571
Benzene-1,3,5-triyl tris-(2,2-dimethyl-propanoate).	2009 Nov 28	21578973
Benzene-1,3,5-triyl triacetate.	2009 Nov 28	21578972
Synthesis and biological activities of 14-epi-MART-10 and 14-epi-MART-11: implications for cancer and osteoporosis treatment.	2009 Sep	19667149
Helical conformations of hexapeptides containing N-terminus diproline segments.	2010	20108314
First principles insight into the alpha-glucan structures of starch: their synthesis, conformation, and hydration.	2010 Apr 14	20302376
Stereochemistry of internucleotide bond formation by the H-phosphonate method. 5. The role of Brønsted and H-bonding base catalysis in ribonucleoside H-phosphonate condensation-chemical and stereochemical consequences.	2010 Aug	20661816
Synthesis of conformationally constrained tricyclic beta-lactam enantiomers through Ugi four-center three-component reactions of a monoterpene-based beta-amino acid.	2010 Feb	19367471
Monocyclic aromatic amines as potential human carcinogens: old is new again.	2010 Jan	19887514
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
3,9-Di-tert-butyl-2,4,8,10-tetra-oxaspiro-[5.5]undeca-ne.	2010 Nov 30	21589636

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:25:54 GMT 2023` Edited by `admin` on `Fri Dec 15 20:25:54 GMT 2023`
Record UNII	SSC20260QW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PIVALDEHYDE

Common Name

English

TERT-PENTANAL

Systematic Name

English

2,2-DIMETHYLPROPANAL

Systematic Name

English

PIVALALDEHYDE

Common Name

English

TERT-VALERALDEHYDE

Common Name

English

TRIMETHYLACETALDEHYDE

Systematic Name

English

NSC-22043

Code

English

NEOPENTALDEHYDE

Common Name

English

.ALPHA.,.ALPHA.-DIMETHYLPROPIONALDEHYDE

Systematic Name

English

PIVALALDEHYDE [MI]

Common Name

English

2,2-DIMETHYLPROPIONALDEHYDE

Systematic Name

English

Code System Code Type Description

NSC

22043