1,3,5-Tri(isopropyl)hexahydro-1,3,5-triazine
Basic information
- CAS
10556-98-6- Standard SMILES
CC(C)N1CN(C(C)C)CN(C(C)C)C1- InChIKey
FBXRCTMIDHCRDT-UHFFFAOYSA-N- Molecular formula
- C12H27N3
- Average molar mass
- 213.36 g/mol
- Monoisotopic mass
- 213.22049787
Names & identifiers
- Preferred name
- 1,3,5-Tri(isopropyl)hexahydro-1,3,5-triazine
- IUPAC
- 1,3,5-tri(propan-2-yl)-1,3,5-triazinane
- English name
- 1,3,5-Triisopropyl hexahydro-sym- triazine
- Molecular formula
- C12H27N3
- Molecular weight
- 213.36
Names & synonyms
1,3,5-Tri(isopropyl)hexahydro-1,3,5-triazine1,3,5-Triisopropylhexahydro-1,3,5-triazine1,3,5-Triazine, hexahydro-1,3,5-tris(1-methylethyl)-Hexahydro-1,3,5-tris(1-methylethyl)-1,3,5-triazineEINECS 234-142-1DTXSID00147202NSC 166334RefChem:412483DTXCID3069693234-142-110556-98-61,3,5-Triisopropyl-1,3,5-triazinane
Show more names
Hexahydro-1,3,5-triisopropyltriazine1,3,5-Triisopropylhexahydro-s-triazineHexahydro-1,3,5-triisopropyl-s-triazine1,3,5-Tiisopropylhexahydro-1,3,5-triazine1,3,5-Triisopropyl-1,3,5-triazacyclohexane2.,3,5-TRIISOPROPYL HEXAHYDRO-SYM- TRIAZINE
1,3,5-tri(propan-2-yl)-1,3,5-triazinanes-Triazine, hexahydro-1,3,5-triisopropyl-1,3,5-tris(propan-2-yl)-1,3,5-triazinane1,3,5-TRIISOPROPYL HEXAHYDRO-SYM- TRIAZINEMFCD00040460NSC-1663341,3,5-Triisopropyl hexahydro-sym-triazineNSC166334
Database identifiers
- CAS
10556-98-6- PubChem CID
- 25374
- DTXSID
DTXSID00147202- UNII
- R2XTF69CUJ
- EC Number
- 234-142-1
- Nikkaji
- J105.198I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 9.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 144
Physicochemical properties
- Boiling point
- 250 ℃ · 250℃
- Density
- 0.904 · 0.904
- Flash point
- 95 ℃ · 95℃
- pka
- 6.78 · 6.78±0.20(Predicted)
- FDA UNII
- 2 XTF69CUJ · R2XTF69CUJ
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 332 · H332-H312-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (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
Regulatory Information1,3,5-Triisopropylhexahydro-1,3,5-triazine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H332-H312-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
Suppliers
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Related reactions
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Compound notes
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