Basic information
- CAS
768-58-1- Standard SMILES
CCC1OCC(C)(C)CO1- InChIKey
QSHOOPIYPOINNH-UHFFFAOYSA-N- Molecular formula
- C8H16O2
- Average molar mass
- 144.21 g/mol
- Monoisotopic mass
- 144.11502975
Names & identifiers
- Preferred name
- 2-Ethyl-5,5-dimethyl-1,3-dioxane
- IUPAC
- 2-ethyl-5,5-dimethyl-1,3-dioxane
- English name
- 2-ethyl-5,5-dimethyl-1,3-dioxane
- Molecular formula
- C8H16O2
- Molecular weight
- 144.21
Names & synonyms
2-Ethyl-5,5-dimethyl-1,3-dioxane768-58-11,3-Dioxane, 2-ethyl-5,5-dimethyl-3UZX3RBK5N2-ethyl-5,5-dimethyl-m-dioxaneDTXSID40227613RefChem:86909DTXCID901501042-5-5-EDD212-197-2MFCD16622268EINECS 212-197-2
Show more names
Chlorotoluron Impurity 8 (Cycluron)2-Ethyl-5,5-dimethyl-1,3-dioxane,99%2-Ethyl-5,5-dimethyl-1,3-dioxane in methanol2-Ethyl-5,5-dimethyl-1,3-dioxane solution in acetonitrile
SCHEMBL3160710SCHEMBL12132583QSHOOPIYPOINNH-UHFFFAOYSA-NAAA768585,5-Dimethyl-2-ethyl-1,3-dioxaneAKOS005137991MSK158185-100MMSK158185-1000M
Database identifiers
- CAS
768-58-1- PubChem CID
- 69852
- DTXSID
DTXSID40227613- UNII
- 3UZX3RBK5N
- EC Number
- 212-197-2
- Nikkaji
- J193.146F
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 99.8
Physicochemical properties
- Boiling point
- 154 ℃ · 154℃
- Density
- 0.88 · 0.88
- Flash point
- 50 ° · 50°(122°F)
- FDA UNII
- 3 UZX3RBK5N · 3UZX3RBK5N
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226
- Precautionary statements
- 261 · P261
- HazardClass
- 3 · 3
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
H226 (80%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P317, P303+P361+P353, P330, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: 1,3-Dioxane, 2-ethyl-5,5-dimethyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (20%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- hazard_class
- 3
- Hazard statements
- H226
- Precautionary statements
- P261
Chemistry & industry
Applications
Uses2-Ethyl-5,5-dimethyl-1,3-dioxane (CAS: 768-58-1) is a useful research compound.
Suppliers20 total
盐城通铭生物科技有限公司15195160625 · [email protected]
江苏星科元信息科技有限公司400-605-7200 15335295587 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海毕楷科技有限公司18516304666 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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