1,4-Bis(isocyanatomethyl)cyclohexan
1,4-Bis(isocyanatomethyl)cyclohexane
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Grundinformationen
- CAS
10347-54-3- Standard-SMILES
O=C=NCC1CCC(CN=C=O)CC1- InChIKey
ROHUXHMNZLHBSF-UHFFFAOYSA-N- Summenformel
- C10H14N2O2
- Durchschnittliche Molmasse
- 194,23 g/mol
- Monoisotopische Masse
- 194,10552769
Namen und Bezeichner
- Bevorzugter Name
- 1,4-Bis(isocyanatomethyl)cyclohexane
- IUPAC
- 1,4-bis(isocyanatomethyl)cyclohexane
- Lokaler Name
- 1,4-Bis(isocyanatomethyl)cyclohexan
- Englischer Name
- 1,4-bis(isocyanatomethyl)cyclohexane
- Summenformel
- C10H14N2O2
- Molmasse
- 194.23
Namen und Synonyme
1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE10347-54-3EINECS 233-757-21,4-Bis(aminomethyl)cyclohexane diisocyanate1,4-Cyclohexane bis(methylisocyanate)Cyclohexane, 1,4-bis(isocyanatomethyl)-DTXSID2065046RefChem:73143DTXCID5032810233-757-21,4-Bis(methylisocyanate)cyclohexaneSCHEMBL44332
Weitere Namen anzeigen
CYCLOHEXANE,1,4-BIS(ISOCYANATOMETHYL)-1,4-Cyclohexanebis(methylene isocyanate)[(1,4-Cyclohexanediyl)bismethylene]diisocyanate[(Cyclohexane-1,4-diyl)bismethylene]bisisocyanate
1,4-Bis(methylisocyanate)cyclohexane [Diisocyanates]SCHEMBL1081546SCHEMBL1081557ROHUXHMNZLHBSF-AOOOYVTPSA-NROHUXHMNZLHBSF-MGCOHNPYSA-N1,4-diisocyanato methylcyclohexaneDTXSID6010315011,4-bis(isocyanatomethyl)-cyclohexane
Datenbank-Bezeichner
- CAS
10347-54-3、98458-83-4- PubChem CID
- 61504
- DTXSID
DTXSID2065046- EC Number
- 233-757-2、825-609-6
- Nikkaji
- J173.799F、J3.483.313C、J3.676.225J
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 3,5
- Polarare Oberfläche (TPSA)
- 58,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 229
Physikochemische Eigenschaften
- Siedepunkt
- 294 ℃ · 294℃
- Dichte
- 1.14 · 1.14
- Flammpunkt
- 119 ℃ · 119℃
- EPA chemische Informationen
- 1 · 1,4-Bis(isocyanatomethyl)cyclohexane (10347-54-3)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P331, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 94 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 11-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26702
DOT LabelPoison
Fire HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Health HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Reactive GroupIsocyanates and Isothiocyanates
Reactivity Profile
Isocyanates and thioisocyanates, such as 1,4-BIS(METHYLISOCYANATE)CYCLOHEXANE, are incompatible with many classes of compounds, reacting exothermically to release toxic gases. Reactions with amines, aldehydes, alcohols, alkali metals, ketones, mercaptans, strong oxidizers, hydrides, phenols, and peroxides can cause vigorous releases of heat. Acids and bases initiate polymerization reactions in these materials. Some isocyanates react with water to form amines and liberate carbon dioxide. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute Tox. 4 (100%)
Sicherheit und Schutzausrüstung
Fire FightingExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
First AidExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Nonfire Spill ResponseExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Isolation and EvacuationExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing InformationCyclohexane, 1,4-bis(isocyanatomethyl)-: INACTIVE
Zugehörige Reaktionen
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