3-methyl-1-[(2-methylallyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Basic information
- CAS
307550-44-3- Standard SMILES
C=C(C)COc1cc(C)cc2oc(=O)c3c(c12)CCCC3- InChIKey
DQZZPCDUJTUOOO-UHFFFAOYSA-N- Molecular formula
- C18H20O3
- Average molar mass
- 284.3 g/mol
- Monoisotopic mass
- 284.1412445
Names & identifiers
- Preferred name
- 3-methyl-1-[(2-methylallyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
- IUPAC
- 3-methyl-1-(2-methylprop-2-enoxy)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one
- English name
- 3-Methyl-1-[(2-methylallyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
- Molecular formula
- C18H20O3
- Molecular weight
- 284.35
Names & synonyms
307550-44-33-methyl-1-[(2-methylallyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-oneOprea1_448572AKOS001063960CCG-320694Z568872493-methyl-1-[(2-methyl-2-propenyl)oxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one3-methyl-1-[(2-methylprop-2-en-1-yl)oxy]-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-6-one3-ME-1-((2-METHYL-2-PROPENYL)OXY)-7,8,9,10-TETRAHYDRO-6H-BENZO(C)CHROMEN-6-ONE6H-Dibenzo[b,d]pyran-6-one, 7,8,9,10-tetrahydro-3-methyl-1-[(2-methyl-2-propen-1-yl)oxy]-
Database identifiers
- CAS
307550-44-3- PubChem CID
- 701959
- EC Number
- 144-219-0
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 477
Physicochemical properties
- Boiling point
- 465.3 · 465.3±45.0 °C(Predicted)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
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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