charge
label: بار @fa

formula
label: فرمول @fa

has_role
label: نقشی دارد @fa

inchi
label: اینچی @fa

inchikey
label: اینچی‌کی @fa

mass
label: جرم @fa

monoisotopicmass
label: جرم تک‌ایزوتوپی @fa

smiles
label: اسمایلٓ @fa

subset
label: زیرمجموعه @fa

synonym EXACT
label: مترادف دقیق @fa

synonym RELATED
label: مترادف مرتبط @fa

allergen
type: Concept
preferred label: آلرژن @fa

isocyanates
type: Concept
narrower: 4-tolyl isocyanate
preferred label: ایزوسیانات‌ها @fa

4-tolyl isocyanate
type: Concept
charge: 0
formula: C8H7NO
has_role: hapten
has_role: allergen
inchi: InChI=1S/C8H7NO/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3
inchikey: MGYGFNQQGAQEON-UHFFFAOYSA-N
mass: 133.14730
monoisotopicmass: 133.05276
smiles: Cc1ccc(cc1)N=C=O
subset: 3_STAR
synonym EXACT: 1-isocyanato-4-methylbenzene
synonym EXACT: 4-Tolyl isocyanate
synonym RELATED: 4-Tol-NCO
synonym RELATED: p-TMI
synonym RELATED: PTI
synonym RELATED: p-Methylphenyl isocyanate
synonym RELATED: Isocyanic acid, p-tolyl ester
synonym RELATED: TMI
synonym RELATED: p-tolylmonoisocyanate
synonym RELATED: 4-Isocyanatotoluene
synonym RELATED: para-tolyl monoisocyanate
synonym RELATED: p-Isocyanatotoluene
synonym RELATED: p-Toluene isocyanate
synonym RELATED: p-Tolyl isocyanate
synonym RELATED: 4-Methylphenyl isocyanate
broader: isocyanates
preferred label: 4 تولیل ایزوسیانات @fa

hapten
type: Concept
preferred label: هاپتن @fa