dicyclohexylmethane-4,4'-diisocyanate (CHEBI:53216)

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ChEBI Name	dicyclohexylmethane-4,4'-diisocyanate

ChEBI ID	CHEBI:53216

Definition	A diisocyanate consisting of dicyclohexylmethane with two isocyanate groups at the 4- and 4'-positions.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C15H22N2O2

Net Charge

Average Mass

262.34740

Monoisotopic Mass

262.16813

InChI

InChI=1S/C15H22N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h12-15H,1-9H2

InChIKey

KORSJDCBLAPZEQ-UHFFFAOYSA-N

SMILES

O=C=NC1CCC(CC1)CC1CCC(CC1)N=C=O

Roles Classification
Biological Role(s):	allergen A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy. (via diisocyanate )

ChEBI Ontology
Outgoing	dicyclohexylmethane-4,4'-diisocyanate (CHEBI:53216) has role allergen (CHEBI:50904) dicyclohexylmethane-4,4'-diisocyanate (CHEBI:53216) is a diisocyanate (CHEBI:53213)

IUPAC Name

1,1'-methylenebis(4-isocyanatocyclohexane)

Synonyms	Sources
4,4'-Diisocyanatodicyclohexylmethane	ChemIDplus
4,4'-Methylenedi(cyclohexyl isocyanate)	NIST Chemistry WebBook
Bis(4-isocyanatocyclohexyl)methane	NIST Chemistry WebBook
dicyclohexylmethane 4,4'-diisocyanate	ChEBI
Dicyclohexylmethane-4,4'-di-isocyanate	NIST Chemistry WebBook
HMDI	ChEBI
Hydrogenated MDI	ChemIDplus
Hylene W	ChemIDplus
Isocyanic acid, methylenedi-4,1-cyclohexylene ester	ChemIDplus
Methylene bis(4-cyclohexylisocyanate)	ChemIDplus
Methylene bis-(4-cyclohexylisocyanate)	ChemIDplus

Last Modified

21 March 2016