Ethylidenenorbornene

HCID 27756CAS 16219-75-3

기본 정보

표준 SMILES
CC=C1CC2C=CC1C2
InChIKey
OJOWICOBYCXEKR-UHFFFAOYSA-N
분자식
C9H12
평균 분자량
120.19 g/mol
단동위원소 질량
120.09390038

개요

Ethylidene norbornene is a colorless liquid with an odor of turpentine. Floats on water.

이름 및 식별자

우선 이름
Ethylidenenorbornene
IUPAC
5-ethylidenebicyclo[2.2.1]hept-2-ene

이름 및 동의어

16219-75-35-ETHYLIDENE-2-NORBORNENE5-Ethylidenebicyclo[2.2.1]hept-2-eneEthylidene norborneneEthylidenenorborneneDTXSID1025306Bicyclo[2.2.1]hept-2-ene, 5-ethylidene-5-Ethylidenebicyclo(2.2.1)hept-2-eneQ4D40UVR0RDTXCID505306Bicyclo(2.2.1)hept-2-ene, 5-ethylidene-5-Ethylidenebicyclo(2.2.1)-hept-2-ene
이름 더 보기
RefChem:9213155,2-ENB5-Ethylidenebicyclo(2,2,1)hept-2-ene240-347-7(5E)-5-Ethylidenebicyclo[2.2.1]hept-2-eneMFCD24390166Ethylidene-2-norborneneethylidene-norbornene

데이터베이스 식별자

CAS
16219-75-3
PubChem CID
27756
DTXSID
DTXSID1025306
ChEMBL
CHEMBL3188004
EC Number
240-347-7

물성

구조 계산 물성

XLogP
2.2
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
0
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical ClassesFlammable agents - 2nd degree
PolymersPlastics & Rubber -> Other Monomers
Odor · 2건

TURPENTINE-LIKE

... Turpentine-like odor.

Density · 5건

0.896 at 68 °F (USCG, 1999) - Less dense than water; will float

0.8958 @ 20 °C

Relative density (water = 1): 0.9

0.90

0.90

Color/FormCOLORLESS LIQUID
Solubility · 2건

less than 1 mg/mL at 64 °F (NTP, 1992)

Solubility in water: none

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H226 (46.5%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P272, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P331, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 858 reports by companies from 21 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H226: Flammable liquid and vapor [Warning Flammable liquids]

유해성 정보

Regulatory Information · 5건

Chemical: Bicyclo[2.2.1]hept-2-ene, 5-ethylidene-

Bicyclo[2.2.1]hept-2-ene, 5-ethylidene- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Bicyclo[2.2.1]hept-2-ene, 5-ethylidene- 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: 19-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/14846

Ethylidene norbornene: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

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 - Bicyclo[2.2.1]hept-2-ene, 5-ethylidene-: Human health tier I assessment
DOT LabelFlammable Liquid
Fire Hazards · 2건

This chemical is flammable. (NTP, 1992)

Flammable. Above 38 °C explosive vapour/air mixtures may be formed.

Health HazardsInhalation of vapors causes headache, confusion, and respiratory distress. Ingestion causes irritation of entire digestive system. Aspiration causes severe pneumonia. Contact with liquid causes irritation of eyes and skin. (USCG, 1999)
Hazards Summary · 1건

Subchronic animal studies (237 ppm for 7 hours/day, 5 days a week for 89 days):kidney and liver lesions, and 10 of 12 rats had testicular atrophy; Human volunteers complain of eye and nose irritation after a 30 minute exposure to either 5.6 ppm (4 subjects) or 11 ppm (2 subjects). [ACGIH] A skin, eye, and respiratory tract irritant; May have liver and kidney effects; [ICSC] Vapor is irritating; If inhaled will cause coughing, headache, and confusion; Will cause reddening of skin if contaminated clothing not removed; [CHRIS]

안전 및 보호

Fire Fighting · 2건

Fire Extinguishing Agents Not to Be Used: Water may be ineffective

Use powder, AFFF, foam, carbon dioxide. NO water. In case of fire: keep drums, etc., cool by spraying with water. Combat fire from a sheltered position.

First Aid Measures · 4건

Fresh air, rest. Refer for medical attention.

Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer for medical attention .

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

Rinse mouth. Refer for medical attention .

First Aid · 2건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

(General first aid procedures)

Safe StorageFireproof. Separated from strong oxidants and food and feedstuffs. Cool. Keep under inert gas. Store only if stabilized.
Fire Fighting ProceduresEXTINGUISH WITH DRY CHEM, ALCOHOL FOAM, OR CARBON DIOXIDE. WATER MAY BE INEFFECTIVE ON FIRE. COOL EXPOSED CONTAINERS WITH WATER.
Storage ConditionsENB should be stored in a nitrogen atmosphere since it reacts with oxygen.

독성 정보

Target OrgansEyes, skin, respiratory system, central nervous system, liver, kidneys, urogenital system, bone marrow
Environmental Fate · 3건

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 900(SRC), determined from a structure estimation method(2), indicates that 5-ethylidene-2-norbornene is expected to have low mobility(SRC). Volatilization of 5-ethylidene-2-norbornene from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 0.13 atm-cu m/mole(SRC), obtained using a fragment constant estimation method(3). The potential for volatilization of 5-ethylidene-2-norbornene from dry soil surfaces may exist based upon an estimated vapor pressure of 3.6 mm Hg(SRC), determined from a fragment constant method(4). Biodegradation is not expected to occur based on the results of screening studies in which 5-ethylidene-2-norbornene did not biodegrade over 4 weeks(5).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 900(SRC), determined from a structure estimation method(2), indicates that 5-ethylidene-2-norbornene is expected to adsorb to suspended solids and sediment in water(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 0.13 atm-cu m/mole(SRC), developed using a fragment constant estimation method(4). Volatilization half-lives for a model river and model lake are 3 hours and 4 days, respectively(SRC), using an estimation method(3). According to a classification scheme(5), a BCF of 70-160(6) suggests bioconcentration in aquatic organisms is moderate to high. Biodegradation is not expected to occur as 5-ethylidene-2-norbornene did not degrade over 4 weeks in screening studies using a mixed inoculum of sludge, soil, and sediment(6).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), 5-ethylidene-2-norbornene, which has an estimated vapor pressure of 3.6 mm Hg at 25 °C(2), is expected to exist solely in the gas phase in the ambient atmosphere. Vapor-phase 5-ethylidene-2-norbornene 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 3 hours from its estimated rate constant of 1.5X10-10 cu cm/molecule-sec at 25 °C(3). The half-life for the reaction with ozone molecules is estimated to be 26 minutes(SRC) calculated from its rate constant of 6.3X10-16 cu cm/molecule-sec at 25 °C(4).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Exposure Routes · 2건

The substance can be absorbed into the body by inhalation and by ingestion.

inhalation, skin absorption, ingestion, skin and/or eye contact

Signs and Symptoms · 5건

Confusion. Cough. Headache. Shortness of breath. Sore throat.

Redness. Pain.

Redness. Pain.

Nausea. Vomiting.

irritation eyes, skin, nose, throat; headache; cough, dyspnea (breathing difficulty); nausea, vomiting; olfactory, taste changes; chemical pneumonitis (aspiration liquid); In Animals: liver, kidney, urogenital injury; bone marrow effects

Soil Adsorption/Mobility · 1건

Using a structure estimation method based on molecular connectivity indices(1), the Koc for 5-ethylidene-2-norbornene is estimated to be 900(SRC). According to a classification scheme(2), this estimated Koc value suggests that 5-ethylidene-2-norbornene is expected to have low mobility in soil.

화학 및 산업

용도 및 제조

Uses · 5건

Used as the third monomer, the diene, in EPDM (ethylene-propylene diene monomer); EPDM is used to make the elastomer, ethylene-propylene terpolymer; [Hawley]

Plastic Composites Manufacturing [Category: Industry]

As third monomer in EPDM (ethylene-propylene diene monomer) elastomers

Monomer in acrylic polymers

Monomer in ethylene-propylene polymers

U.S. Production2023: 50,000,000 - <100,000,000 lb
Consumer UsesMonomers
Industry UsesIntermediate
Formulations/PreparationsGRADES OF PURITY: COMMERCIAL, 99+%.
General Manufacturing Information · 2건

Plastics Material and Resin Manufacturing

Bicyclo[2.2.1]hept-2-ene, 5-ethylidene-: ACTIVE

관련 반응

19건

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