Basic information
- CAS
13036-83-4- Standard SMILES
CCCCN1CN(CCCC)CN(CCCC)C1- InChIKey
OIQDTXAPPNRLAS-UHFFFAOYSA-N- Molecular formula
- C15H33N3
- Average molar mass
- 255.44 g/mol
- Monoisotopic mass
- 255.26744807
Names & identifiers
- Preferred name
- 1,3,5-Triazine, 1,3,5-tributylhexahydro-
- IUPAC
- 1,3,5-tributyl-1,3,5-triazinane
- English name
- 1,3,5-Tributylhexahydro-1,3,5-triazine
- Molecular formula
- C15H33N3
- Molecular weight
- 255.44
Names & synonyms
1,3,5-Tributylhexahydro-1,3,5-triazine1,3,5-Triazine, 1,3,5-tributylhexahydro-EINECS 235-905-1DTXSID7065334RefChem:72303DTXCID9033977235-905-11,3,5-Tributyl-1,3,5-triazinane13036-83-41,3,5-Triazine,1,3,5-tributylhexahydro-MFCD00040462s-Triazine, 1,3,5-tributylhexahydro-
Show more names
1,3,5-TRI-N-BUTYLHEXAHYDRO-S-TRIAZINE1,3,5-Tributylhexahydro-1,3,5-trizine1,3,5-TRIBUTYLHEXAHYDRO-1,3,5-TRIAZINE 98+%
SCHEMBL54876621,3,5-Tributylhexahydro-s-triazineSTK802318AKOS0056225441,3,5-Tributyl-1,3,5-triazinane #DA-12821Hexahydro-1,3,5-tri-n-butyl-S-triazineVS-02832
Database identifiers
- CAS
13036-83-4- PubChem CID
- 83069
- DTXSID
DTXSID7065334- EC Number
- 235-905-1
- Nikkaji
- J103.307G
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Boiling point
- 285 ℃ · 285℃
- Density
- 0.876 · 0.876±0.06 g/cm3 (20 ºC 760 Torr)
- refractive index
- 1.4575 · 1.4575 (20℃)
- Flash point
- 124.3 · 124.3±10.3℃
- pka
- 6.71 · 6.71±0.20(Predicted)
- InChI
- InChI=1S/C15H33N3/c1-4-7-10-16-13-17(11-8-5-2)15-18(14-16)12-9-6-3/h4-15H2,1-3H3
- InChIKey
- OIQDTXAPPNRLAS-UHFFFAOYSA-N
- SMILES
- N1(CCCC)CN(CCCC)CN(CCCC)C1
- EPA Substance Registry System
- 1 · 1,3,5-Triazine, 1,3,5-tributylhexahydro- (13036-83-4)
- TSCA
- TSCA listed
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 ClassificationNot Classified
Hazard information
Regulatory Information1,3,5-Tributylhexahydro-1,3,5-triazine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3,5-Triazine, 1,3,5-tributylhexahydro-: INACTIVE
Suppliers11 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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