Basic information
- CAS
104336-01-8- Standard SMILES
CCOC(OCC)c1cnco1- InChIKey
XRMACLJEBLOSGG-UHFFFAOYSA-N- Molecular formula
- C8H13NO3
- Average molar mass
- 171.19 g/mol
- Monoisotopic mass
- 171.08954328
Names & identifiers
- Preferred name
- Oxazole, 5-(diethoxymethyl)-
- IUPAC
- 5-(diethoxymethyl)-1,3-oxazole
- English name
- 5-(diethoxyMethyl)oxazole
- Molecular formula
- C8H13NO3
- Molecular weight
- 171.19
Names & synonyms
104336-01-8Oxazole, 5-(diethoxymethyl)-DTXSID70340743RefChem:367262DTXCID90291824XRMACLJEBLOSGG-UHFFFAOYSA-N5-(Diethoxymethyl)oxazole5-(Diethoxymethyl)-1,3-oxazole5-((Diethoxy)methyl)oxazoleSCHEMBL70923485-(Diethoxymethyl)-1,3-oxazole #F16490
Database identifiers
- CAS
104336-01-8- PubChem CID
- 566978
- DTXSID
DTXSID70340743
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 115
Physicochemical properties
- Boiling point
- 201 ℃ · 201℃
- Density
- 1.061 · 1.061
- Flash point
- 75 ℃ · 75℃
Chemistry & industry
Suppliers6 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
常州琬瑶生物科技有限公司051989185693 15312551983 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
上海拓朴医药科技有限公司+86 (21) 5196-9732
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
重庆卡兰医药有限公司[email protected]
Related reactions
17 records
Compound notes
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