Toluene-2,4,6-triyl triisocyanate
Basic information
- CAS
7373-26-4- Standard SMILES
Cc1c(N=C=O)cc(N=C=O)cc1N=C=O- InChIKey
PFUKECZPRROVOD-UHFFFAOYSA-N- Molecular formula
- C10H5N3O3
- Average molar mass
- 215.16 g/mol
- Monoisotopic mass
- 215.03309103
Names & identifiers
- Preferred name
- Toluene-2,4,6-triyl triisocyanate
- IUPAC
- 1,3,5-triisocyanato-2-methylbenzene
- English name
- toluene-2,4,6-triyl triisocyanate
- Molecular formula
- C10H5N3O3
- Molecular weight
- 215.16
Names & synonyms
1,3,5-triisocyanato-2-methylbenzeneToluene-2,4,6-triyl triisocyanate7373-26-4EINECS 230-932-5DTXSID90224056RefChem:898572DTXCID90146547230-932-52,4,6-trisisocyanatotolueneSCHEMBL15317SCHEMBL9422449PFUKECZPRROVOD-UHFFFAOYSA-N
Show more names
Benzene, 1,3,5-triisocyanato-2-methyl-2-Methylbenzene-1,3,5-triyltrisisocyanate
NS00037551
Database identifiers
- CAS
7373-26-4- PubChem CID
- 81845
- DTXSID
DTXSID90224056- EC Number
- 230-932-5
- Nikkaji
- J212.374F
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 362
Physicochemical properties
- Melting point
- 75 °C · 75 °C
- Boiling point
- 133 · 133-139 °C(Press: 1-3 Torr)
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 8 · GHS08,GHS06
- Signal word
- Danger
- Hazard statements
- 335 · H335-H412-H315-H334-H330-H351-H319
- Precautionary statements
- 273 · P273-P501-P261-P285-P304+P341-P342+P311-P501-P264-P280-P305+P351+P338-P337+P313P-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P203, P233, P260, P261, P264, P264+P265, P271, P273, P280, P284, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P320, P321, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS06
- Hazard statements
- H335-H412-H315-H334-H330-H351-H319
- Precautionary statements
- P273-P501-P261-P285-P304+P341-P342+P311-P501-P264-P280-P305+P351+P338-P337+P313P-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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