Propyne

HCID 6335CAS 74-99-7

Grundinformationen

Standard-SMILES
C#CC
InChIKey
MWWATHDPGQKSAR-UHFFFAOYSA-N
Summenformel
C3H4
Durchschnittliche Molmasse
40,06 g/mol
Monoisotopische Masse
40,03130013

Überblick

1-propyne appears as a colorless liquefied gas with a sweet odor. mp: -104 °C, bp: -23.1 °C. Insoluble in water, soluble in ethanol, chloroform and benzene. Moderately toxic by inhalation. Used as a specialty fuel. Denser than air. Vapors may ignite at distant sources of ignition and flash back.

Namen und Bezeichner

Bevorzugter Name
Propyne
IUPAC
prop-1-yne
Lokaler Name
Propin
Englischer Name
Propyne
Summenformel
C3H4
Molmasse
40.06

Namen und Synonyme

PropyneMethylacetyleneprop-1-yne1-PROPYNEAllylene74-99-7Methyl acetyleneAcetylene, methyl-086L40ET1BDTXSID0026387CHEBI:48086RefChem:6178
Weitere Namen anzeigen
Propine2-PropyneCH3CequivCHPropyne 96%Propyne,95%
DTXCID406387200-828-4METHYLACETYLENE-D1MFCD000362357299-37-8Propyne, ca. 4% in N,N-Dimethylformamide, ca. 1.0mol/LPropynylidyneAllylene; Methylacetylene; Propine

Datenbank-Bezeichner

CAS
74-99-7
PubChem CID
6335
DTXSID
DTXSID0026387
ChEMBL
CHEMBL116902
ChEBI
CHEBI:48086
UNII
086L40ET1B
EC Number
200-828-4
Nikkaji
J1.434F、J808.214F

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,9
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
0
Schwere Atome
3

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Other Classes -> Aliphatics, Unsaturated

Flammable agents - 4th degree

SpringerMaterials PropertiesDunham energy parameter
LogPlog Kow = 0.94
OdorSweet odor
Density · 5 Einträge

0.607 at 25 °C/4 °C

Density (liquid) at 250 deg K = 0.671 g/ cu m

Relative density (water = 1): 0.70

.607 (p> 1 atm)

1.41(relative gas density)

Viscositygas at 298 deg K: 8.4X10-3 mPa-s; liquid at 233 deg K: 0.26 mPa-s

Physikochemische Eigenschaften

Schmelzpunkt
-102.7 °C · -102.7 °C (lit.)
Siedepunkt
-23.2 °C · -23.2 °C (lit.)
Dichte
0.607 · 0.6070
Dampfdruck
204.6 mm · 204.6 mm Hg ( −49.5 °C)
Brechungsindex
1.3863 · 1.3863
Flammpunkt
-51 °C · -51 °C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H220 (98.8%): Extremely flammable gas [Danger Flammable gases]

P203, P210, P222, P261, P271, P280, P304+P340, P319, P377, P381, P403, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 346 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H220: Extremely flammable gas [Danger Flammable gases]

Gefahrenhinweise

Regulatory Information · 5 Einträge

Chemical: 1-Propyne

1-Propyne is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propyne are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 19-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24875

Methyl acetylene: HSNO Approval: HSR003018 Approved with controls

The 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.)

Other Safety InformationIMAP assessments - 1-Propyne: Human health tier I assessment
DOT LabelFlammable Gas
Fire Hazards · 2 Einträge

Excerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

Extremely flammable. Gas/air mixtures are explosive.

Fire Potential · 3 Einträge

Dangerous, when exposed to heat or flame

Induced decomposition of the endothermic hydrocarbon leads to flame propagation in absence of air above minimum pressures of 3.4 and 2.1 bar at 20 and 120 °C, respectively.

The gas is heavier than air and may travel along the ground; distant ignition possible. As a result of flow, agitation, etc., electrostatic charges can be generated.

Health HazardsExcerpt from NIOSH Pocket Guide for Methyl acetylene:

Sicherheit und Schutzausrüstung

Fire Fighting · 2 Einträge

Excerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

Shut off supply; if not possible and no risk to surroundings, let the fire burn itself out. In other cases extinguish with water spray. In case of fire: keep cylinder cool by spraying with water. Combat fire from a sheltered position.

First Aid Measures · 3 Einträge

Fresh air, rest. Artificial respiration may be needed. Refer for medical attention.

ON FROSTBITE: rinse with plenty of water, do NOT remove clothes.

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

First Aid · 2 Einträge

Excerpt from NIOSH Pocket Guide for Methyl acetylene:

(General first aid procedures)

Safe StorageFireproof. Cool.
Firefighting Hazards · 2 Einträge

On loss of containment this gas can cause suffocation by lowering the oxygen content of the air in confined areas.

The gas is heavier than air and may travel along the ground; distant ignition possible. As a result of flow, agitation, etc., electrostatic charges can be generated.

Fire Fighting Procedures · 2 Einträge

Shut off supply; if not possible and no risk to surroundings, let the fire burn itself out; in other cases extinguish with water spray ... Keep cylinder cool by spraying with water. Combat fire from a sheltered position.

To fight fire, stop the flow of gas.

Toxikologische Informationen

Body Burden1-Propyne has been detected in the human respiratory air at 0.81 ug/hr in a non-smoker and at 1.1 and 2.3 ug/hr in two smokers(1).
Target Organsrespiratory system, central nervous system
Environmental Fate · 3 Einträge

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 77(SRC), determined from a log Kow of 0.94(2) and a regression-derived equation(3), indicates that 1-propyne is expected to have high mobility in soil(SRC). Volatilization of 1-propyne from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 0.011 atm-cu m/mole(SRC), derived from its vapor pressure, 4.31X10+3 mm Hg(4), and water solubility, 3,640 mg/L(5). 1-Propyne is expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(4). 1-Propyne readily volatilizes from dry and moist soil surfaces. 1-Propyne volatilizes readily from water and moist soil surfaces; therefore, biodegradation studies in these environments are difficult(SRC). Biodegradation studies in soil were not located(SRC, 2006).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 77(SRC), determined from a log Kow of 0.94(2) and a regression-derived equation(3), indicates that 1-propyne is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 0.011 atm-cu m/mole(SRC) derived from its vapor pressure, 4.31X10+3 mm Hg(4), and water solubility, 3,640 mg/L(5). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 41 min and 2.5 days, respectively(SRC). According to a classification scheme(6), an estimated BCF of 3(SRC), from its log Kow(2) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is low(SRC). 1-Propyne volatilizes readily from water and moist soil surfaces; therefore, biodegradation studies in these environments are difficult(SRC). Biodegradation studies in water were not located(SRC, 2006).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), 1-propyne, which has a vapor pressure of 4.31X10+3 mm Hg at 25 °C(2), is expected to exist solely as a gas in the ambient atmosphere. Gas-phase 1-propyne is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 2.7 days(SRC), calculated from its rate constant of 5.9X10-12 cu cm/molecule-sec at 25 °C(3). 1-Propyne does not contain chromophores that absorb at wavelengths >290 nm and therefore is not expected to be susceptible to direct photolysis by sunlight(4).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Exposure Routes · 2 Einträge

The substance can be absorbed into the body by inhalation.

inhalation, skin and/or eye contact (liquid)

Signs and Symptoms · 3 Einträge

Dizziness. Headache. Nausea. Unconsciousness.

ON CONTACT WITH LIQUID: FROSTBITE.

irritation respiratory system; tremor, hyperexcitability, anesthesia; liquid: frostbite

Regulatorische Informationen

DHS Chemicals of Interest (COI) · 4 Einträge

Propyne

1

10000

Flammable chemical that can be released at a facility.

Sicherheitsdaten

OEB
A
OEL
TWA: 1000 ppm (1650 mg/m3)
wgk
-
IDLA
1,700 ppm [10% LEL]
tsca
TSCA listed
ridadr
UN 1954 2.1

Chemie und Industrie

Pharmakologische Informationen

Absorption, Distribution and Excretion · 2 Einträge

Propyne has been detected in exhaled air at 0.81 mg/hr in nonsmokers, and at 1.1 and 2.3 mg/hr in smokers.

... /Propyne/ can be absorbed into the body by inhalation.

Verwendung und Herstellung

Uses · 3 Einträge

Used as a welding fuel and chemical intermediate; [ACGIH]

Gas Welding and Cutting [Category: Weld]

... Propyne is used as a welding torch fuel, as a specialty fuel, and chemical intermediate.

U.S. Production · 3 Einträge

2023: 1,000,000 - <8,500,000 lb

This chemical is listed as a High Production Volume (HPV) (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and/or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B; 51FR21438).

Production volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#3932]

Consumer UsesIntermediate
Industry UsesIntermediate
Methods of Manufacturing · 3 Einträge

Thermal or catalytic pyrolysis of propene

Propyne and propadiene can be recovered from cracked gas by solvent extraction.

In ethylene plants ... removed by selective hydrogenation of the C3 stream after it has been separated from heavier hydrocarbons.

General Manufacturing Information · 2 Einträge

Petrochemical Manufacturing

1-Propyne: ACTIVE

Anwendungen

VerwendenPropyne is produced by thermal or catalytic pyrolysis of propene. Like acetylene, propyne is used as a welding torch fuel, as a specialty fuel, and chemical intermediate.

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
安徽旺山旺水特种气体有限公司15906197626 · [email protected]
江西核研院新材料有限公司18901398682 18901398682 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]

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