Basic information
- CAS
4401-11-0- Standard SMILES
CC(=O)C1CO1- InChIKey
YBWJKTAELMMCHQ-UHFFFAOYSA-N- Molecular formula
- C4H6O2
- Average molar mass
- 86.09 g/mol
- Monoisotopic mass
- 86.03677943
Names & identifiers
- Preferred name
- Ethanone, 1-oxiranyl-
- IUPAC
- 1-(oxiran-2-yl)ethanone
- English name
- 2-Acetyloxirane
- Molecular formula
- C4H6O2
- Molecular weight
- 86.09
Names & synonyms
4401-11-0Ethanone, 1-oxiranyl-1-Oxiranylethanone2-Butanone, 3,4-epoxy-NSC 344504RefChem:138366YBWJKTAELMMCHQ-UHFFFAOYSA-N2-Acetyloxirane1-(oxiran-2-yl)ethanone1-(Oxiran-2-yl)ethan-1-one1-Oxiran-2-ylethanoneacetyloxirane
Show more names
3,4-Epoxy-2-butanoneEthanone, 1-(2-oxiranyl)-
2-Butanone,4-epoxy-MFCD008292051-(2-Oxiranyl)ethanone #NSC344504SCHEMBL728797SCHEMBL28025795NSC-344504DB-051185
Database identifiers
- CAS
4401-11-0- PubChem CID
- 20429
- Nikkaji
- J129.192K
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 29.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 77.6
Physicochemical properties
- Boiling point
- 45 · 45-46/30mm
- Density
- 1.139 · 1.139±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H302-H315-H319-H335
- Precautionary statements
- 210 · P210-P280
- HS Code
- 2910900090 · 2910900090
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
- hs_code
- 2910900090
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H226-H302-H315-H319-H335
- Precautionary statements
- P210-P280
Chemistry & industry
Suppliers8 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海宣月科技有限公司15216675652 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海腾渤医药科技有限公司021-54338626 18017892860 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…