NITROMETHANE

Details

Stereochemistry	ACHIRAL
Molecular Formula	CH3NO2
Molecular Weight	61.04
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[N+]([O-])=O

InChI

InChIKey=LYGJENNIWJXYER-UHFFFAOYSA-N

InChI=1S/CH3NO2/c1-2(3)4/h1H3

HIDE SMILES / InChI

Molecular Formula	CH3NO2
Molecular Weight	61.04
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
Bifunctional-thiourea-catalyzed diastereo- and enantioselective aza-Henry reaction.	2005-12-23	16187368
Intramolecular [4 + 2] cycloaddition of nitroalkenes for construction of vicinal quaternary stereocenters.	2005-12-08	16321005
Hydrogen/Chlorine exchange reactions of gaseous carbanions.	2005-12	16246573
Stark slowing asymmetric rotors: weak-field-seeking states and nonadiabatic transitions.	2005-11-15	16321086
Surface-initiated atom transfer radical polymerization on poly(vinylidene fluoride) membrane for antibacterial ability.	2005-10-20	16208631
Two fatal intoxication cases with imidacloprid: LC/MS analysis.	2005-10-04	15922528
Asymmetric aza-Henry reactions from N-p-tolylsulfinylimines.	2005-09-29	16178545
X-ray diffraction and DOSY NMR characterization of self-assembled supramolecular metallocyclic species in solution.	2005-08-03	16045362
Model car fuel poisoning.	2005-07	15989733
Nitromethane as solvent in capillary electrophoresis.	2005-06-24	16038311
Convenient synthesis of 1 --> 3 C-branched dendrons.	2005-06-10	15932340
Dynamic and structural NMR studies of cavitand-based coordination cages.	2005-05-18	15884946
Highly enantioselective conjugate addition of nitromethane to chalcones using bifunctional cinchona organocatalysts.	2005-05-12	15876031
On the possibility of molecular recognition of taste substances studied by Gábor analysis of oscillations.	2005-04-22	15829341
Prodrug-oriented molecular design of neonicotinoids: preparation of imidacloprid-related 5,5-dimethoxy-1,3-diazacyclohexane derivatives and their insecticidal activity.	2005-04	15849408
Highly efficient approach to orthogonally protected (2S,4R)- and (2S,4S)-4-hydroxyornithine.	2005-03-31	15787522
Syntheses, structural analyses and redox kinetics of four-coordinate [CuL2]2+ and five-coordinate [CuL2(solvent)]2+ complexes (L = 6,6'-dimethyl-2,2'-bipyridine or 2,9-dimethyl-1,10-phenanthroline): completely gated reduction reaction of [Cu(dmp)2]2+ in nitromethane.	2005-03-21	15739009
Role of surface crossings in the photochemistry of nitromethane.	2005-02-22	15836056
Efficient stereoselective synthesis of gamma-N-glycosyl asparagines by N-glycosylation of primary amide groups.	2005-02-16	15700984
Coupled cluster methods including triple excitations for excited states of radicals.	2005-02-01	15740313
Functionalization of pyrimidine and purine nucleosides at C4 and C6: C-nucleophilic substitution of their C4- and C6-(1,2,4-triazol-1-yl) derivatives.	2005	16248088
Dynamic equilibrium between a supramolecular capsule and bowl generated by inter- and intramolecular metal clipping.	2004-12-17	15549767
Quantitative structure-activity relationship study using refractotopological state atom index on some neonicotinoid insecticides.	2004-12-01	15519158
Reserpine methonitrate, a novel quaternary analogue of reserpine augments urinary excretion of VMA and 5-HIAA without affecting HVA in rats.	2004-11-16	15546495
Condensation reactions of monomeric hydroxo palladium complexes with active methyl and methylene compounds.	2004-11-07	15510272
Comparative analysis of neonicotinoid binding to insect membranes: I. A structure-activity study of the mode of [3H]imidacloprid displacement in Myzus persicae and Aphis craccivora.	2004-10	15481821
Tandem overman rearrangement and intramolecular amidomercuration reactions. stereocontrolled synthesis of cis- and trans-2,6-dialkylpiperidines.	2004-09-02	15330589
Multiconfigurational second-order perturbation study of the decomposition of the radical anion of nitromethane.	2004-09-01	15332959
Self-assembly of flexible supramolecular metallacyclic ensembles: structures and adsorption properties of their nanoporous crystalline frameworks.	2004-09-01	15327323
Mutagenicity in Salmonella of halonitromethanes: a recently recognized class of disinfection by-products in drinking water.	2004-08-08	15279829
Efficient proton-templated synthesis of 18- to 38-membered tetraimino(amino)diphenol macrocyclic ligands: structural features and spectroscopic properties.	2004-08-06	15287791
CH overtone spectrum of nitromethane: a C3V coupled oscillator analysis using local mode parameters.	2004-08	15249017
Meisenheimer complexes bonded at carbon and at oxygen.	2004-07	15234359
Myoglobin as an efficient electrocatalyst for nitromethane reduction.	2004-06-28	15206865
A molecular-dynamics study of structural and physical properties of nitromethane nanoparticles.	2004-06-01	15268047
Early chemistry in hot and dense nitromethane: molecular dynamics simulations.	2004-06-01	15268037
Molecular electron affinities and the calculation of the temperature dependence of the electron-capture detector response.	2004-05-28	15214661
Spin trapping of nitric oxide by aci anions of nitroalkanes.	2004-03	15135358
[(NH3)5Ru(1,2,4,5-tetrazine)]2+: synthesis and experimental and theoretical study of its solvatochromism in the visible spectral region.	2004-02-23	14966973
Controlling the selectivity of competitive nitroaldol condensation by using a bifunctionalized mesoporous silica nanosphere-based catalytic system.	2004-02-04	14746455
Gas-phase ion-molecule reactions of small nitroalkanes and their deprotonated anions.	2004	15103100
A new and efficient synthesis of pyrrolo[2,3-d]pyrimidine anticancer agents: Alimta (LY231514, MTA), homo-Alimta, TNP-351, and some aryl 5-substituted pyrrolo[2,3-d]pyrimidines.	2003-12-26	14682686
Highly diastereoselective addition of nitromethane anion to chiral alpha-amidoalkylphenyl sulfones. Synthesis of optically active alpha-amino acid derivatives.	2003-12-07	14685331
Solvent compatibility of poly(dimethylsiloxane)-based microfluidic devices.	2003-12-01	14640726
Secondary benzylation using benzyl alcohols catalyzed by lanthanoid, scandium, and hafnium triflate.	2003-11-28	14629155
A new copper acetate-bis(oxazoline)-catalyzed, enantioselective Henry reaction.	2003-10-22	14558801
Conversion of D-glucose to cyclitol with hydroxymethyl substituent via intramolecular silyl nitronate cycloaddition reaction: application to total synthesis of (+)-cyclophellitol.	2003-10-16	14535733
Synthesis and properties of RNA analogues having amides as interuridine linkages at selected positions.	2003-10-08	14518999
Mechanism of formation of hydrogen trioxide (HOOOH) in the ozonation of 1,2-diphenylhydrazine and 1,2-dimethylhydrazine: an experimental and theoretical investigation.	2003-09-24	13129358
Stopped-flow Fourier transform infrared spectroscopy of nitromethane oxidation by the diiron(IV) intermediate of methane monooxygenase.	2003-09-17	16220908

Patents

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:41:12 GMT 2025` Edited by `admin` on `Wed Apr 02 18:41:12 GMT 2025`
Record UNII	RU5WG8C3F4
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-428

Preferred Name

English

NITROMETHANE

Official Name

English

METHANE, NITRO-

Systematic Name

English

NITROMETHANE [HSDB]

Common Name

English

NITROMETHANE [USP-RS]

Common Name

English

NITROCARBOL

Common Name

English

NITROMETHANE [IARC]

Common Name

English

NITROMETHANE [MI]

Common Name

English

Classification Tree Code System Code

IARC

Nitromethane

NCI_THESAURUS

C45179