Basic information
- CAS
34841-20-8- Standard SMILES
CCn1cc(C(C)=O)c(=O)c2cc3c(cc21)OCO3- InChIKey
KOHITSRPJYWLST-UHFFFAOYSA-N- Molecular formula
- C14H13NO4
- Average molar mass
- 259.26 g/mol
- Monoisotopic mass
- 259.0844579
Names & identifiers
- Preferred name
- 1,3-Dioxolo(4,5-g)quinolin-8(5H)-one, 7-acetyl-5-ethyl-
- IUPAC
- 7-acetyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-8-one
- English name
- 7-acetyl-5-ethyl-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one
- Molecular formula
- C14H13NO4
- Molecular weight
- 259.25732
Names & synonyms
34841-20-8BRN 10820441,3-DIOXOLO(4,5-g)QUINOLIN-8(5H)-ONE, 7-ACETYL-5-ETHYL-7-Acetyl-5-ethyl-1,3-dioxolo(4,5-g)quinolin-8(5H)-oneDTXSID20188394RefChem:219053DTXCID501108857-Acetyl-5-ethyl-[1,3]dioxolo[4,5-g]quinolin-8(5H)-oneAKOS0243283897-acetyl-5-ethyl[1,3]dioxolo[4,5-g]quinolin-8(5H)-one7-Acetyl-5-ethyl-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one7-acetyl-5-ethyl-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one
Database identifiers
- CAS
34841-20-8- PubChem CID
- 36943
- DTXSID
DTXSID20188394- EC Number
- 669-139-8
- Nikkaji
- J33.516I
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 445
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…