1-HEPTENE CAS 592-76-7

Introduction:Basic information about 1-HEPTENE CAS 592-76-7, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

1-HEPTENE Basic information

Product Name:1-HEPTENE
Synonyms:1-Heptene 97%;1-HEPTENE, 98+%1-HEPTENE, 98+%1-HEPTENE, 98+%1-HEPTENE, 98+%;1-C7H14;1-n-Heptene;alpha-heptylene;hept-1-ene;Heptylene;n-Hept-1-ene
CAS:592-76-7
MF:C7H14
MW:98.19
EINECS:209-767-8
Product Categories:1-Olefins (GC Standard);Analytical Chemistry;Standard Materials for GC;Alphabetic;H;HA -HTChemical Class;Hydrocarbons;Neats;Acyclic;Alkenes;Organic Building Blocks;NeatsGasoline, Diesel,&Petroleum;Olefins;Substance classes
Mol File:592-76-7.mol

1-HEPTENE Chemical Properties

Melting point -119 °C (lit.)
Boiling point 94 °C (lit.)
density 0.697 g/mL at 25 °C (lit.)
vapor pressure 101 mm Hg ( 37.7 °C)
refractive index n20/D 1.400(lit.)
Fp 16 °F
storage temp. Store below +30°C.
solubility water: soluble0.0182g/L at 25°C
form Liquid
Specific Gravity0.698
color Clear colorless
OdorLike gasoline.
Odor Threshold0.37ppm
explosive limit1-7%(V)
Water Solubility 18.17mg/L(25 ºC)
BRN 1098332
Dielectric constant2.1(20℃)
Stability:Volatile
InChI1S/C7H14/c1-3-5-7-6-4-2/h3H,1,4-7H2,2H3
InChIKeyZGEGCLOFRBLKSE-UHFFFAOYSA-N
SMILESCCCCCC=C
CAS DataBase Reference592-76-7(CAS DataBase Reference)
EPA Substance Registry System1-Heptene (592-76-7)

Safety Information

Hazard Codes F,Xn
Risk Statements 11-36/37/38-65
Safety Statements 16-26-36-62
RIDADR UN 2278 3/PG 2
WGK Germany 1
RTECS MJ8840000
10
Autoignition Temperature505 °F
TSCA TSCA listed
HS Code 2901 29 00
HazardClass 3
PackingGroup II
Storage Class3 - Flammable liquids
Hazard ClassificationsAsp. Tox. 1
Flam. Liq. 2
Hazardous Substances Data592-76-7(Hazardous Substances Data)

1-HEPTENE Usage And Synthesis

DescriptionHeptene is a colorless liquid with a mild, gaso-line-like odor. Molecular weight = 98.21;Boilingpoint= 94℃;Flashpoint≤0℃; Autoignitiontemperature = 260℃.Explosivelimits:LEL= 1.0%;UEL- -unknown. Hazard Identification (based on NFPA-704 M Rating System): Health 0, Flammability 3,Reactivity 0. Insoluble in water.
Chemical Propertiesclear colorless liquid
Chemical PropertiesHeptene is a colorless liquid. Mild, gasoline like odor.
Chemical Properties1-Heptene is a colorless, highly flammable liquidwith specific gravity 0.697.
Uses1-Heptene can be used as a reactant for the gold(I)-catalyzed stereoselective olefin cyclopropanation of alkenes. Also it is a volatile organic compound which acts as a pollutant in the atmosphere.
UsesOrganic synthesis.
Production MethodsHeptene is produced in a process involving the oligomerizationof ethene in the presence of aluminum alkyls.
DefinitionChEBI: 1-Heptene is a hydrocarbon.
Synthesis Reference(s)Journal of the American Chemical Society, 101, p. 5414, 1979 DOI: 10.1021/ja00512a051
Tetrahedron Letters, 31, p. 7115, 1990 DOI: 10.1016/S0040-4039(00)97255-1
Synthetic Communications, 17, p. 969, 1987 DOI: 10.1080/00397918708063955
General DescriptionThe liquid phase alkylation of toluene with 1-heptene has been investigated over a HFAU zeolite.
HazardFlammable, dangerous fire risk.
Health HazardRecommended Personal Protective Equipment: Safety goggles or face shield; Symptoms Following Exposure: High concentrations may produce slight irritation of eyes and respiratory tract; also acts as simple asphyxiant and slight anesthetic; General Treatment for Exposure: Remove from exposure. Administer artificial respirator if needed; Toxicity by Inhalation: Data not available; Short-Term Inhalation Limits: Data not available; Toxicity by Ingestion: Data not available; Late Toxicity: Data not available; Vapor (Gas) Irritant Characteristics: Vapors cause a slight smarting of the eyes or respiratory system if present in high concentrations. Effects are temporary; Liquid or Solid Irritant Characteristics: Minimum hazard. If spilled on clothing and allowed to remain, may cause smarting and reddening of the skin; Odor Threshold: Data not available.
Chemical ReactivityReactivity with Water No reaction; Reactivity with Common Materials: No reactions; Stability During Transport: Stable; Neutralizing Agents for Acids and Caustics: Not pertinent; Polymerization: Not pertinent; Inhibitor of Polymerization: Not pertinent.
Potential ExposureA potential danger to those involvedin use as a plant growth retardant or in organic synthesis.
First aidIf this chemical gets into the eyes, remove anycontact lenses at once and irrigate immediately for at least15 min, occasionally lifting upper and lower lids. Seek med-ical attention immediately. If this chemical contacts theskin, remove contaminated clothing and wash immediately with soap and water. Seek medical attention immediately. Ifthis chemical has been inhaled, remove from exposure,begin rescue breathing (using universal precautions, includ-ing resuscitation mask) if breathing has stopped and CPR ifheart action has stopped. Transfer promptly to a medicalfacility. When this chemical has been swallowed, get medi-cal attention. Give large quantities of water and induce :vomiting. Do not make an unconscious person vomit.
storageColor Code- Red: Flammability Hazard: Store ina flammable liquid storage area or approved cabinet awayfrom ignition sources and corrosive and reactive materials.Prior to working with heptene you should be trained on itsproper handling and storage. Before entering confined spacewhere heptene may be present, check to make sure that anexplosive concentration does not exist. Store in tightlyclosed containers in a cool, well-venti lated area away fromoxidizers. Metal containers involving the transfer of thischemical should be grounded and bonded. Where possible,automatically pump liquid from drums or other storage con-tainers to process containers. Drums must be equipped withself-closing valves, pressure vacuum bungs, and flamearresters. Use only nonsparking tools and equipment, espe-cially when opening and closing containers of this chemi-cal. Sources of ignition, such as smoking and open flames,are prohibited where this chemical is used, handled, orstored in a manner that could create a potential fire orexplosion hazard. Wherever this chemical is used, handled,manufactured, or stored, use explosion-proof e lectricalequipment and fittings.
ShippingUN2278 n-Heptene, Hazard Class: 3; Labels:3-Flammable liquid.
Purification MethodsDistil hept-1-ene from sodium, then carefully distil it fractionally using an 18-in gauze-packed column. It can also be purified by azeotropic distillation with EtOH. It usually contains the 2-and 3-isomers as impurities. These can be removed by gas chromatography using a Carbowax column at 70o. [Beilstein 1 IV 857.]
IncompatibilitiesVapor may form explosive mixture withair. Incompatible with oxidizers (chlorates, nitrates, peroxides,permanganates, perchlorates, chlorine, bromine, fluorine,etc.); contact may cause fires or explosions. Keep away fromalkaline materials, strong bases, strong acids, oxoacids, epox ides. May react exothermically with reducing agents releasingflammable hydrogen gas.
Toxics Screening LevelThe initial threshold screening level (ITSL) for 1-HEPTENE is 24 μg/m3 (annual averaging time).
Waste DisposalDissolve or mix the materialwith a combustible solvent and burn in a chemical incinera tor equipped with an afterburner and scrubber. All federal,state, and local environmental regulations must beobserved.

1-HEPTENE Preparation Products And Raw materials

Raw materialsTRANS-2-OCTENOIC ACID-->1,3-Dimethoxypropane-->N-HEPTYL ETHER-->METHYL TRANS-2-OCTENOATE-->CIS-1,2-DIMETHYLCYCLOPENTANE-->Allyl phenyl sulfone-->trans-1,2-DiMethylcyclopentane-->N-BUTYLMAGNESIUM BROMIDE-->TRANS-2-OCTENE-->1-Heptanol
Preparation Products1-Octanol-->Heptanoic acid-->2,2-DIMETHYL-3-(2-METHYLPROP-1-ENYL)CYCLOPROPANECARBOXYLIC ACID-->gamma-Nonanolactone-->isometheptene-->octamylamine-->2,4-DECADIENOIC ACID METHYL ESTER-->1-HEPTEN-3-ONE
1-Heptanol CAS 111-70-6
1-HEXADECANESULFONIC ACID SODIUM SALT CAS 15015-81-3
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