2,4,6-Tris(methylthio)-1,3,5-triazine
Completing data — refresh the page later to see the latest
Basic information
- CAS
5759-58-0- Standard SMILES
CSc1nc(SC)nc(SC)n1- InChIKey
KMWQATAKCGOGFB-UHFFFAOYSA-N- Molecular formula
- C6H9N3S3
- Average molar mass
- 219.4 g/mol
- Monoisotopic mass
- 218.99586082
Names & identifiers
- Preferred name
- 2,4,6-Tris(methylthio)-1,3,5-triazine
- IUPAC
- 2,4,6-tris(methylsulfanyl)-1,3,5-triazine
- English name
- 2,4,6-TRIS(METHYLTHIO)-1,3,5-TRIAZINE
- Molecular formula
- C6H9N3S3
- Molecular weight
- 219.35
Names & synonyms
5759-58-02,4,6-Tris(methylthio)-1,3,5-triazine2,4,6-Tris(methylsulfanyl)-1,3,5-triazines-Triazine, 2,4,6-tris(methylthio)-1,3,5-Triazine, 2,4,6-tris(methylthio)-2,4,6-TRIS(METHYLTHIO)-S-TRIAZINEGA2U24VR6KNSC 39444BRN 0151508AI3-61120NSC-39444DTXSID90206216
Show more names
TIMTEC-BB SBB0023882,4,6-tris(methylthio)-s-triazin2,4,6-Tris(methylsulphanyl)-1,3,5-triazine
5-26-03-00549 (Beilstein Handbook Reference)RefChem:443011DTXCID90128707691-100-9MFCD01678800tris(methylsulfanyl)-1,3,5-triazineC6H9N3S3NSC39444
Database identifiers
- CAS
5759-58-0- PubChem CID
- 21982
- DTXSID
DTXSID90206216- UNII
- GA2U24VR6K
- EC Number
- 691-100-9
- Nikkaji
- J54.415I
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 99.4
Physicochemical properties
- FDA UNII
- 2 U24VR6K · GA2U24VR6K
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H332-H302
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2933698090 · 2933698090
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+H312+H332 (96.6%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
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)
Aggregated GHS information provided per 29 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 CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933698090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H312-H332-H302
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…