2,4,6-Trimorpholino-1,3,5-triazine
Basic information
- CAS
16303-23-4- Standard SMILES
C1CN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)CCO1- InChIKey
GHKBOCAECRMABJ-UHFFFAOYSA-N- Molecular formula
- C15H24N6O3
- Average molar mass
- 336.39 g/mol
- Monoisotopic mass
- 336.19098865
Overview
structure in first source
Names & identifiers
- Preferred name
- 2,4,6-Trimorpholino-1,3,5-triazine
- IUPAC
- 4-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)morpholine
- English name
- 2,4,6-tris(morpholino)-1,3,5-triazine
- Molecular formula
- C15H24N6O3
- Molecular weight
- 336.39
Names & synonyms
2,4,6-trimorpholino-1,3,5-triazineRefChem:4430122,4,6-trimorpholino-1,3,5-triazin16303-23-42,4,6-Tris(morpholino)-1,3,5-triazine1,3,5-Triazine, 2,4,6-tri-4-morpholinyl-TRIS(MORPHOLIN-4-YL)-1,3,5-TRIAZINE4-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)morpholineAI3-5124162BE4YP783NSC-808632,4-Bis(morpholin-4-yl)-6-(morpholin-4-yl)-1,3,5-triazine
Show more names
2,4,6-tris(1-morpholino)-1,3,5-triazine2,4,6-Tri(4-morpholinyl)-1,3,5-triazine3,5-Triazine, 2,4,6-tri-4-morpholinyl-14,4',4''-(s-Triazine-2,4,6-triyl)tris(morpholine)
F2704-01552,4,6-tri(morpholin-4-yl)-1,3,5-triazineNSC80863EINECS 240-391-7ChemDiv1_000300Oprea1_034407Oprea1_275678MLS000711076
Database identifiers
- CAS
16303-23-4- PubChem CID
- 85361
- DTXSID
DTXSID60167502- ChEMBL
CHEMBL189616- UNII
- 62BE4YP783
- EC Number
- 240-391-7
- Nikkaji
- J286.863F
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 316
Experimental & physicochemical properties
Solubility20.6 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 284 · 284-289 °C (decomp)
- Boiling point
- 571.7 · 571.7±60.0 °C(Predicted)
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- pka
- 7.8 · 7.80±0.10(Predicted)
- FDA UNII
- 62 BE4YP783 · 62BE4YP783
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H332-H312
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P
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, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P337+P317, 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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319-H332-H312
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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