Methylnitrit

Methyl nitrite

HCID 12231CAS 624-91-9

Grundinformationen

Standard-SMILES
CON=O
InChIKey
BLLFVUPNHCTMSV-UHFFFAOYSA-N
Summenformel
H3CONO
Durchschnittliche Molmasse
61,04 g/mol
Monoisotopische Masse
61,01637834

Überblick

Methyl nitrite appears as a liquid or gas Boils at 10.4 °F. Moderately toxic by inhalation. Narcotic in high concentrations. Used as a rocket propellant. Differs from nitromethane (H3CNO2).

Namen und Bezeichner

Bevorzugter Name
Methyl nitrite
IUPAC
methyl nitrite
Lokaler Name
Methylnitrit
Englischer Name
Nitrous acid methyl ester
Summenformel
CH3NO2
Molmasse
61.04

Namen und Synonyme

Methyl nitrite624-91-9Nitrous acid, methyl ester96TLP8RN37DTXSID8060795RefChem:157964DTXCID5043346210-870-5Methylester kyseliny dusiteHSDB 7197Methylester kyseliny dusite [Czech]EINECS 210-870-5
Weitere Namen anzeigen
Nitrous acid methylMonostearin Impurity 10Nitrous acid methyl esterNitrous acid, methylester,cas:624-91-9
Methyl nitrite [Forbidden]UNII-96TLP8RN37METHYLNITRITECH3ONOMethyl ester of nitrous acidSCHEMBL91335METHYL NITRITE [HSDB]AKOS006277932

Datenbank-Bezeichner

CAS
624-91-9
PubChem CID
12231
DTXSID
DTXSID8060795
UNII
96TLP8RN37
EC Number
210-870-5
Nikkaji
J4.485G

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0
Polarare Oberfläche (TPSA)
38,7 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
0
Schwere Atome
4

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Nitrogen Compounds -> Nitrates and Nitrites

Flammable agents - 4th degree

LogPlog Kow = 0.88 /Estimated/
Density0.991
Color/FormGas
Solubility · 2 Einträge

Soluble in ethanol and ether

In water, 2.4X10-4 mg/L @ 25 °C /Estimated/

Boiling Point64.6 °C @ 760 mm Hg (explodes)

Physikochemische Eigenschaften

Schmelzpunkt
-16.99 °C · -16.99°C
Siedepunkt
-12 °C · -12°C
Dichte
0.991 · 0.9910
Brechungsindex
1.3418 · 1.3418 (estimate)
Henry's Law Constant
1.5 · 1.5×10-1 mol/(m3Pa) at 25℃, HSDB (2015)
EPA chemische Informationen
Methyl nitrite (624-91-9)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

Danger

H221: Flammable gas [Danger Flammable gases]

P210, P260, P264, P270, P271, P284, P304+P340, P308+P316, P316, P320, P321, P377, P381, P403, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory InformationThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelForbidden
Fire Hazards · 2 Einträge

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable)]:

· EXTREMELY FLAMMABLE.

Health Hazards · 2 Einträge

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable)]:

· Vapors may cause dizziness or asphyxiation without warning, especially when in closed or confined areas.

Hazards SummaryCaused methemoglobinemia in two workers at a phenylpropanolamine production plant; [Abstract in PubMed and NIOSHTIC # 197071] Evaporating liquid can cause frostbite; [CAMEO]
DOT ID and Guide2455 116

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 116 [Gases - Flammable (Unstable)]:
Accidental Release Measures · 2 Einträge

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 Einträge

Excerpt from ERG Guide 116 [Gases - Flammable (Unstable)]:

General First Aid:

Exposure Control and Personal Protection · 2 Einträge

· Wear positive pressure self-contained breathing apparatus (SCBA).

Biological Exposure Indices (BEI) [ACGIH] - Methemoglobin in blood = 1.5% of hemoglobin during or at end of shift. [ACGIH]

Nonfire Spill ResponseExcerpt from ERG Guide 116 [Gases - Flammable (Unstable)]:
Disposal Methods · 1 Eintrag

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.

Toxikologische Informationen

Environmental Fate · 3 Einträge

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 44(SRC), determined from a structure estimation method(2), indicates that methyl nitrite is expected to have very high mobility in soil(SRC). Volatilization of methyl nitrite from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 6.6X10-5 atm-cu m/mole(SRC), using a fragment constant estimation method(3). The potential for volatilization of methyl nitrite from dry soil surfaces may exist (SRC) based upon an estimated vapor pressure of 1,650 mm Hg(SRC), determined from a fragment constant method(4).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 44(SRC), determined from a structure estimation method(2), indicates that methyl nitrite is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces may occur(3) based upon an estimated Henry's Law constant of 6.6X10-5 atm-cu m/mole(SRC), developed using a fragment constant estimation method(4). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 8 hours and 150 hours, respectively(SRC). According to a classification scheme(5), an estimated BCF of 3(SRC), from an estimated log Kow of 0.88(6) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is low(SRC).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), methyl nitrite, which has an estimated vapor pressure of 1,600 mm Hg at 25 °C(SRC), determined from a fragment constant method(2), is expected to exist solely as a gas in the ambient atmosphere. Methyl nitrite absorbs light in the environmental spectrum(4), therefore the potential for direct photolysis exists.

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as primary toxic effect.
Effluent ConcentrationsMethyl nitrite was detected, not quantified in emissions from a waste incineration plant in Germany, where primarily mixed waste was treated(1). The compound was detected, not quantified in the exhaust of a methanol-fueled automobile(2).
Soil Adsorption/Mobility · 1 Eintrag

Using a structure estimation method based on molecular connectivity indices(1), the Koc for methyl nitrite can be estimated to be 44(SRC). According to a classification scheme(2), this estimated Koc value suggests that methyl nitrite is expected to have very high mobility in soil.

Human Toxicity Excerpts · 3 Einträge

/CASE REPORTS/ Two workers from the same factory presented to the same emergency department within six weeks of one another with moderate (Case 1) and severe (Case 2) methemoglobinemia. Subsequent investigation revealed that the factory produces phenylpropanolamine and that both patients, shortly before becoming ill, were inadvertently exposed to methyl nitrite, a critical reagent in this production. Although other nitrites induce methemoglobinemia, exposure to methyl nitrite during phenylpropanolamine production appears to be a new cause of occupational methemoglobinemia.

/CASE REPORTS/ ...A case of fatal /methhemoglobinemia/ (MetHb) due to occupational exposure to methyl nitrite as a result of phenylpropanolamine (PPA) production .../is reported/. Through case report and factory investigation, the causality was demonstrated. Three previous healthy pharmaceutical production workers... developed general weakness, chest tightness, dizziness, and cyanosis while working at the PPA production line. On the arrival of Emergency Department, the MetHb levels were 35.8%, 46.3%, and 68.0% respectively. The last worker died two hours later due to lack of antidote (methylene blue) during the transportation to /the/ hospital. Factory investigation revealed that these three workers were responsible for the production of PPA in the last two years. During the regular procedure, methyl nitrite was developed as an active intermediate reagent in the closed tank to produce PPA. In the morning of this accident, one of the three victims failed to /make sure the tank was empty/. The left-over sulfuric acid reacted with sodium nitrite and the disaster occurred by methyl nitrite which was leaked from the /open/ manhole. ...

/CASE REPORTS/ Methyl nitrite was found to be a potent cyanosing agent for workers synthesizing a rubber antioxidant. Six cases of methyl nitrite intoxication are described, consisting initially of dizziness and later headache and palpitation, the last more pronounced in two workers who consumed alcohol after exposure at work. All men responded satisfactorily to bed rest for 12 hr and inhaling of oxygen for about 2 hr. Atmospheric concentrations in the plants where the men had been affected, simulating the conditions at the time of intoxications, indicated that "50 ppm is the uppermost limit of safety". Another incident, when it was estimated that workers were exposed to 50-100 ppm, caused cyanosis, dizziness, and nausea but complete recovery after exposure ceased.

Artificial Pollution Sources · 1 Eintrag

Methyl nitrite's production and use as a raw material for the synthesis of nitrite and nitrosos esters(1) may result in its release to the environment through various waste streams(SRC). Its former use as a rocket propellant(2) resulted in its direct relesase to the environment.

Sicherheitsdaten

tsca
TSCA listed
ridadr
UN 2455
hazard_class
2.2
Giftige Stoffe Daten
624-91-9(Hazardous Substances Data)

Chemie und Industrie

Verwendung und Herstellung

Uses · 3 Einträge

Used to synthesize nitrite and nitroso esters and as a rocket propellant; [HSDB]

It has uses in the synthesis of nitrite and nitroso esters.

Rocket propellant /Former/

General Manufacturing InformationNitrous acid, methyl ester: ACTIVE

Anwendungen

VerwendenSynthesis of nitrile and nitroso esters.

Anbieter10 Anbieter

广州佳途科技股份有限公司81960175 18933936954 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
淄博桓明新材料有限公司15264351707 15264351707 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]

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