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Isophorone diisocyanate, 98%, Thermo Scientific Chemicals

Catalog No. AC427602500
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This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Chemical Identifiers

CAS

4098-71-9

Molecular Formula

C12H18N2O2

Molecular Weight (g/mol)

222.29

MDL Number

MFCD00064956

InChI Key

NIMLQBUJDJZYEJ-UHFFFAOYNA-N

Synonym

isophorone diisocyanate, ipdi, isophorone diamine diisocyanate, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane, 3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate, cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl, 3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, ccris 6252, isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester, isophorone diisocyanate diisocyanates

PubChem CID

169132

ChEBI

CHEBI:53214

IUPAC Name

5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane

SMILES

CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O

Specifications

Color

Colorless to Yellow

Density

1.0610g/mL

Boiling Point

153.0°C (10.0 mmHg)

Flash Point

163°C

Infrared Spectrum

Authentic

Assay Percent Range

97.5% min. (sum of mixed isomers) (GC)

Packaging

Glass bottle

Refractive Index

1.4830 to 1.4850 (20°C, 589nm)

Quantity

250 mL

Specific Gravity

1.061

Viscosity

13-15 mPa.s (23°C)

Formula Weight

222.28

Percent Purity

98%

Physical Form

Liquid

Chemical Name or Material

Isophorone diisocyanate

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Hazard Category

GHS Signal Word: Danger

Hazard Statement

GHS H Statement
Causes skin irritation.
May cause an allergic skin reaction.
May cause respiratory irritation.
May cause allergy or asthma symptoms or breathing difficulties if inhaled.
Toxic to aquatic life with long lasti

Precautionary Statement

GHS P Statement
IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing.
IF ON SKIN: Wash with plenty of soap and water.
If skin irritation occurs: Get medical advice/attention.
If skin irritation or

EINECSNumber

223-861-6
SDS

RUO – Research Use Only

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