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EC number: 938-351-5 | CAS number: -
- Life Cycle description
- Uses advised against
- Endpoint summary
- Appearance / physical state / colour
- Melting point / freezing point
- Boiling point
- Density
- Particle size distribution (Granulometry)
- Vapour pressure
- Partition coefficient
- Water solubility
- Solubility in organic solvents / fat solubility
- Surface tension
- Flash point
- Auto flammability
- Flammability
- Explosiveness
- Oxidising properties
- Oxidation reduction potential
- Stability in organic solvents and identity of relevant degradation products
- Storage stability and reactivity towards container material
- Stability: thermal, sunlight, metals
- pH
- Dissociation constant
- Viscosity
- Additional physico-chemical information
- Additional physico-chemical properties of nanomaterials
- Nanomaterial agglomeration / aggregation
- Nanomaterial crystalline phase
- Nanomaterial crystallite and grain size
- Nanomaterial aspect ratio / shape
- Nanomaterial specific surface area
- Nanomaterial Zeta potential
- Nanomaterial surface chemistry
- Nanomaterial dustiness
- Nanomaterial porosity
- Nanomaterial pour density
- Nanomaterial photocatalytic activity
- Nanomaterial radical formation potential
- Nanomaterial catalytic activity
- Endpoint summary
- Stability
- Biodegradation
- Bioaccumulation
- Transport and distribution
- Environmental data
- Additional information on environmental fate and behaviour
- Ecotoxicological Summary
- Aquatic toxicity
- Endpoint summary
- Short-term toxicity to fish
- Long-term toxicity to fish
- Short-term toxicity to aquatic invertebrates
- Long-term toxicity to aquatic invertebrates
- Toxicity to aquatic algae and cyanobacteria
- Toxicity to aquatic plants other than algae
- Toxicity to microorganisms
- Endocrine disrupter testing in aquatic vertebrates – in vivo
- Toxicity to other aquatic organisms
- Sediment toxicity
- Terrestrial toxicity
- Biological effects monitoring
- Biotransformation and kinetics
- Additional ecotoxological information
- Toxicological Summary
- Toxicokinetics, metabolism and distribution
- Acute Toxicity
- Irritation / corrosion
- Sensitisation
- Repeated dose toxicity
- Genetic toxicity
- Carcinogenicity
- Toxicity to reproduction
- Specific investigations
- Exposure related observations in humans
- Toxic effects on livestock and pets
- Additional toxicological data
Reference substances
- IUPAC name:
- 1-[(5-{3-[(5-{3-[(5-{3-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4-dioxo-1,3-diazetidin-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-2,4-dioxo-1,3-diazetidin-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-2,4-dioxo-1,3-diazetidin-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-3-[3-({3-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4-dioxo-1,3-diazetidin-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-1,3-diazetidine-2,4-dione
Inventory
Synonyms
- Names:
- Isophorone diisocyanate, oligomerization product, uretdione type, n = 6
Molecular and structural information
- Molecular formula:
- C72H108N12O12
- Molecular weight:
- 1 333.74
- SMILES notation:
- O=C=NC1CC(C)(C)CC(C)(C1)CN2C(=O)N(C2=O)CC3(C)CC(C)(C)CC(C3)N4C(=O)N(C4=O)CC5(C)CC(C)(C)CC(C5)N6C(=O)N(C6=O)CC7(C)CC(C)(C)CC(C7)N8C(=O)N(C8=O)CC9(C)CC(C)(C)CC(C9)N1C(=O)N(C1=O)CC2(C)CC(C)(C)CC(C2)N=C=O
- InChl:
- InChI=1S/C72H108N12O12/c1-61(2)19-45(73-43-85)21-67(13,31-61)37-75-51(87)76(52(75)88)39-69(15)27-47(23-63(5,6)33-69)82-55(91)78(56(82)92)41-71(17)29-49(25-65(9,10)35-71)84-59(95)80(60(84)96)42-72(18)30-50(26-66(11,12)36-72)83-57(93)79(58(83)94)40-70(16)28-48(24-64(7,8)34-70)81-53(89)77(54(81)90)38-68(14)22-46(74-44-86)20-62(3,4)32-68/h45-50H,19-42H2,1-18H3
- Structural formula:
Related substances
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