8-chloro-7-[(4-fluorobenzyl)oxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Basic information
- CAS
303134-64-7- Standard SMILES
O=c1oc2cc(OCc3ccc(F)cc3)c(Cl)cc2c2c1CCC2- InChIKey
MPXQPQYBCGGDSL-UHFFFAOYSA-N- Molecular formula
- C19H14ClFO3
- Average molar mass
- 344.8 g/mol
- Monoisotopic mass
- 344.0615502
Names & identifiers
- Preferred name
- 8-chloro-7-[(4-fluorobenzyl)oxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
- IUPAC
- 8-chloro-7-[(4-fluorophenyl)methoxy]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
- English name
- 8-chloro-7-[(4-fluorobenzyl)oxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
- Molecular formula
- C19H14ClFO3
- Molecular weight
- 344.76
Names & synonyms
8-chloro-7-[(4-fluorobenzyl)oxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one303134-64-78-CHLORO-7-((4-FLUOROBENZYL)OXY)-2,3-DIHYDROCYCLOPENTA(C)CHROMEN-4(1H)-ONE8-chloro-7-((4-fluorobenzyl)oxy)-2,3-dihydrocyclopenta[c]chromen-4(1H)-oneCBMicro_0273048-chloro-7-[(4-fluorophenyl)methoxy]-2,3-dihydro-1H-cyclopenta[c]chromen-4-oneOprea1_340690Oprea1_601105EiM07-13772STK375224AKOS000522430BIM-0027469.P001
Show more names
Cyclopenta[c][1]benzopyran-4(1H)-one, 8-chloro-7-[(4-fluorophenyl)methoxy]-2,3-dihydro-
ST50005624AB00682075-01AG-690/12888969Z568461738-chloro-7-[(4-fluorophenyl)methoxy]-1,2,3-trihydrocyclopenta[2,1-c]chromen-4- one8-chloro-7-[(4-fluorophenyl)methoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Database identifiers
- CAS
303134-64-7- PubChem CID
- 721085
- EC Number
- 140-535-8
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 527
Physicochemical properties
- Boiling point
- 529.9 · 529.9±50.0 °C(Predicted)
- Density
- 1.41 · 1.41±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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, 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 CategoriesEye Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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