Basic information
- CAS
1245816-14-1- Standard SMILES
CS([O])(=O)=C1N=C=CS1.[CH2]CCC.[CH2]CCC.[CH2]CCC.[Sn]- InChIKey
QVPQZKBRXRVABD-UHFFFAOYSA-N- Molecular formula
- C16H31NO2S2Sn
- Average molar mass
- 452.3 g/mol
- Monoisotopic mass
- 453.081824
Names & identifiers
- Preferred name
- Tributyl-(2-methylsulfonylthiazol-4-yl)stannane
- English name
- 2-(methylsulfonyl)-4-(tributylstannyl)thiazole
- Molecular formula
- C16H31NO2S2Sn
- Molecular weight
- 452.26
Names & synonyms
MFCD17015019tributyl-(2-methylsulfonylthiazol-4-yl)stannane2-(methylsulfonyl)-4-(tributylstannyl)thiazoleThiazole, 2-(methylsulfonyl)-4-(tributylstannyl)-2-(methylsulfonyl)-4-(tributylstannyl)thiazole - [T5758]
Database identifiers
- CAS
1245816-14-1- PubChem CID
- 175688036
Properties
Computed structural properties
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- form
- solid
- InChI
- 1S/C4H4NO2S2.3C4H9.Sn/c1-9(6,7)4-5-2-3-8-4;3*1-3-4-2;/h3H,1H3;3*1,3-4H2,2H3;
- InChIKey
- QVPQZKBRXRVABD-UHFFFAOYSA-N
- SMILES
- CCCC[Sn](CCCC)(CCCC)c1csc(n1)S(C)(=O)=O
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 301 · H301-H312-H315-H319-H360FD-H372-H410
- Precautionary statements
- 202 · P202-P273-P280-P301+P310-P302+P352+P312-P305+P351+P338
- WGK Germany
- 3 · WGK 3
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 OralAcute · Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- WGK 3
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS08,GHS09
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301-H312-H315-H319-H360FD-H372-H410
- Hazard Classifications
- Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
- Precautionary statements
- P202-P273-P280-P301+P310-P302+P352+P312-P305+P351+P338
Chemistry & industry
Applications
Uses2-(Methylsulfonyl)-4-(tributylstannyl)thiazole is used as a reactant in the synthesis of heterocyclic compounds as PI3 kinase inhibitors.
Suppliers3 total
常州凯瑞化学科技有限公司+86 (519) 8689-6136 · [email protected]
上海汉尊生物科技有限公司021-50215258 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…