Methyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetate
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Basic information
- CAS
433703-81-2- Standard SMILES
COC(=O)Cc1c(C)c2ccc(O)c(C)c2oc1=O- InChIKey
VHNZFXKDCIJJSH-UHFFFAOYSA-N- Molecular formula
- C14H14O5
- Average molar mass
- 262.26 g/mol
- Monoisotopic mass
- 262.08412354
Names & identifiers
- Preferred name
- Methyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetate
- IUPAC
- methyl 2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetate
- English name
- Methyl (7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetate
- Molecular formula
- C14H14O5
- Molecular weight
- 262.26
Names & synonyms
433703-81-2Methyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetatemethyl (7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetatemethyl 2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetateMethyl 7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-acetateMFCD03146921Oprea1_557410TQR1121HMS1615A06ISA70381STL457128AKOS001666052
Show more names
methyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-3-chromenyl)acetatemethChemicalbookyl2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-3-chromenyl)acetate2H-1-Benzopyran-3-acetic acid, 7-hydroxy-4,8-dimethyl-2-oxo-, methyl estermethyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetate - [AC78434]7-Hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-carboxylic acid methyl ester
NCGC00320869-01CS-0245312EU-0014663EN300-302985H57411AB00296578-03F660510methyl 2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetate
Database identifiers
- CAS
433703-81-2- PubChem CID
- 5408212
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 426
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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