3,4,8-trimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-chromen-2-one
Basic information
- CAS
374759-33-8- Standard SMILES
CC(C)=CCOc1ccc2c(C)c(C)c(=O)oc2c1C- InChIKey
OSAYVGADUFMSOQ-UHFFFAOYSA-N- Molecular formula
- C17H20O3
- Average molar mass
- 272.34 g/mol
- Monoisotopic mass
- 272.1412445
Names & identifiers
- Preferred name
- 3,4,8-trimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-chromen-2-one
- IUPAC
- 3,4,8-trimethyl-7-(3-methylbut-2-enoxy)chromen-2-one
- English name
- 3,4,8-trimethyl-7-(3-methylbut-2-enoxy)chromen-2-one
- Molecular formula
- C17H20O3
- Molecular weight
- 272.34
Names & synonyms
3,4,8-trimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-chromen-2-one374759-33-83,4,8-trimethyl-7-((3-methylbut-2-en-1-yl)oxy)-2H-chromen-2-oneSTL459458AKOS0163756243,4,8-TRIMETHYL-7-((3-METHYL-2-BUTENYL)OXY)-2H-CHROMEN-2-ONE3,4,8-trimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one3,4,8-trimethyl-7-(3-methylbut-2-enoxy)chromen-2-one2H-1-Benzopyran-2-one, 3,4,8-trimethyl-7-[(3-methyl-2-buten-1-yl)oxy]-
Database identifiers
- CAS
374759-33-8- PubChem CID
- 853027
- EC Number
- 140-040-7
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 443
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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