Basic information
- CAS
5371-49-3- Standard SMILES
CC(=O)OCC=O- InChIKey
GUPGZURVZDIQPM-UHFFFAOYSA-N- Molecular formula
- C4H6O3
- Average molar mass
- 102.09 g/mol
- Monoisotopic mass
- 102.03169405
Names & identifiers
- Preferred name
- 2-Oxoethyl acetate
- IUPAC
- 2-oxoethyl acetate
- English name
- ACETYLOXYACETALDEHYDE
- Molecular formula
- C4H6O3
- Molecular weight
- 102.09
Names & synonyms
2-oxoethyl acetate5371-49-3DTXSID90455646RefChem:264947DTXCID80406465848-038-4Acetyloxyacetaldehyde2-(acetyloxy)AcetaldehydeacetoxyacetaldehydeAcetaldehyde, (acetyloxy)-acetic acid 2-oxo-ethyl esteracetaldehyde acetate
Show more names
Acetyloxyacetaldehyde 98%Acetaldehyde,2-(acetyloxy)-
MFCD00043840SCHEMBL208357SCHEMBL208358SCHEMBL8682610SCHEMBL10883675GUPGZURVZDIQPM-UHFFFAOYSA-NAKOS005068230DA-27942
Database identifiers
- CAS
5371-49-3- PubChem CID
- 11115995
- DTXSID
DTXSID90455646- EC Number
- 848-038-4
- Nikkaji
- J847.370F
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 77
Physicochemical properties
- Melting point
- 208 °C · 208 °C
- Boiling point
- 90 °C · 90 °C(Press: 50 Torr)
- Density
- 1.21 g/cm3 · 1.21 g/cm3(Temp: 24 °C)
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H226-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- HS Code
- 2914500090 · 2914500090
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 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- hs_code
- 2914500090
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- Hazard statements
- H319-H335-H226-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
卓瑞宁（上海）科技有限公司18163338995 18163338995 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
武汉沃格达生物科技有限公司15071299552 · [email protected]
Wuhan Topule Biopharmaceutical Co., Ltd+86-18327326525 · [email protected]
Related reactions
2 records
Compound notes
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