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10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-5H-benzo[c]furo[3,2-g]chromen-5-one

HCID 707752
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
374710-33-5
Standard SMILES
Cc1c2occ(-c3ccc(F)cc3)c2cc2c3c(c(=O)oc12)CCCC3
InChIKey
XYFQMYZPNLLBOB-UHFFFAOYSA-N
Molecular formula
C22H17FO3
Average molar mass
348.4 g/mol
Monoisotopic mass
348.11617256

Names & identifiers

Preferred name
10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-5H-benzo[c]furo[3,2-g]chromen-5-one
IUPAC
10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one
English name
10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one
Molecular formula
C22H17FO3
Molecular weight
348.37

Names & synonyms

10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-5H-benzo[c]furo[3,2-g]chromen-5-one374710-33-5Oprea1_019298STL456821AKOS001666957EU-008141110-(4-fluorophenyl)-7-methyl-3,4-dihydro-1H-benzo[c]furo[3,2-g]chromen-5(2H)-one10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one10-(4-FLUOROPHENYL)-7-ME-1,2,3,4-TETRAHYDRO-5H-BENZO(C)FURO(3,2-G)CHROMEN-5-ONE10-(4-fluorophenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one5H-[2]Benzopyrano[4,3-f]benzofuran-5-one, 10-(4-fluorophenyl)-1,2,3,4-tetrahydro-7-methyl-

Database identifiers

CAS
374710-33-5
PubChem CID
707752
EC Number
144-367-6

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
26
Formal charge
0
Complexity
607

Physicochemical properties

Boiling point
546.2 · 546.2±50.0 °C(Predicted)
Density
1.34 · 1.34±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 · 4 items

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%)

Chemistry & industry

Suppliers1 total

Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]

Related reactions

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Compound notes

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