1,3,5-Triazine, 2,4,6-trimethyl-
Basic information
- CAS
823-94-9- Standard SMILES
Cc1nc(C)nc(C)n1- InChIKey
LASVAZQZFYZNPK-UHFFFAOYSA-N- Molecular formula
- C6H9N3
- Average molar mass
- 123.16 g/mol
- Monoisotopic mass
- 123.0796473
Names & identifiers
- Preferred name
- 1,3,5-Triazine, 2,4,6-trimethyl-
- IUPAC
- 2,4,6-trimethyl-1,3,5-triazine
- English name
- 2,4,6-trimethyl-1,3,5-triazine
- Molecular formula
- C6H9N3
- Molecular weight
- 123.16
Names & synonyms
2,4,6-Trimethyl-1,3,5-triazine823-94-91,3,5-Triazine, 2,4,6-trimethyl-AI3-61023DTXSID80231678RefChem:412505DTXCID10154169977-034-6trimethyl-1,3,5-triazineMFCD00456896Trimethyl-s-triazine2,4,6-TRIMETHYL-S-TRIAZINE
Show more names
Finerenone Impurity 80
s-Triazine, 2,4,6-trimethyl-Trimethyl-s-triazinSCHEMBL924608QSJ96J78Morb3216081LASVAZQZFYZNPK-UHFFFAOYSA-N2,4,6-trimethyl-[1,3,5]triazineAKOS027324978
Database identifiers
- CAS
823-94-9- PubChem CID
- 13208
- DTXSID
DTXSID80231678- UNII
- 8QSJ96J78M
- EC Number
- 977-034-6
- Nikkaji
- J505.737J
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 63.3
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 59 · 59-60 °C
- Boiling point
- 154 · 154-156 °C(Press: 750 Torr)
- Density
- 1.044 · 1.044±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.41 · 3.41±0.10(Predicted)
- Appearance
- 60 °C · Off-white to light yellow 60°C Liquid
- InChI
- InChI=1S/C6H9N3/c1-4-7-5(2)9-6(3)8-4/h1-3H3
- InChIKey
- LASVAZQZFYZNPK-UHFFFAOYSA-N
- SMILES
- N1=C(C)N=C(C)N=C1C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…