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hexyl isocyanate
A hexane modified by a single isocyanato substituent, found to be immunogenic in guinea pigs.


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03. Biological Effects of Specific Chemicals: immunomodulator [CHEBI:50846] > hexyl isocyanate [CHEBI:59058]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 immunomodulator [CHEBI:50846] (61) 
 hexyl isocyanate [CHEBI:59058] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 organonitrogen compound [CHEBI:35352] (6705) 
 isocyanates [CHEBI:53212] (23) 
 hexyl isocyanate [CHEBI:59058] (1)
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 organooxygen compound [CHEBI:36963] (11352) 
 isocyanates [CHEBI:53212] (23) 
 hexyl isocyanate [CHEBI:59058] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 isocyanates [CHEBI:53212] (23) 
 hexyl isocyanate [CHEBI:59058] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organonitrogen compound [CHEBI:35352] (6705) 
 isocyanates [CHEBI:53212] (23) 
 hexyl isocyanate [CHEBI:59058] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 isocyanates [CHEBI:53212] (23) 
 hexyl isocyanate [CHEBI:59058] (1)
ChEBI Compound Accession Identifier  [CHEBI:59058]
ChEBI Compound Description  A hexane modified by a single isocyanato substituent, found to be immunogenic in guinea pigs.
ChEBI Compound Identification Number  59058
ChEBI InChI Value  InChI=1S/C7H13NO/c1-2-3-4-5-6-8-7-9/h2-6H2,1H3
ChEBI InChIKey Value  ANJPRQPHZGHVQB-UHFFFAOYSA-N
ChEBI Compound Name  hexyl isocyanate
ChEBI SMILES Value  CCCCCCN=C=O
ChEBI Substance ID  92741966
ChEBI URL  ChEBI:59058
ChemSpider ID  68179
Ontomatica Chemical Accession Key (OnChAKey)  ANJPRQPHZGHVQB_UHFFFAOYSA_N_000_000000
PubChem Compound ID  75659