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3,4-dimethyl-9,10-dihydrocyclopenta[c]furo[2,3-f]chromen-7(8H)-one

HCID 854571
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
374763-09-4
Standard SMILES
Cc1coc2c1c(C)cc1oc(=O)c3c(c12)CCC3
InChIKey
MEDBZLODHWAXID-UHFFFAOYSA-N
Molecular formula
C16H14O3
Average molar mass
254.28 g/mol
Monoisotopic mass
254.0942943

Names & identifiers

Preferred name
3,4-dimethyl-9,10-dihydrocyclopenta[c]furo[2,3-f]chromen-7(8H)-one
IUPAC
5,7-dimethyl-3,10-dioxatetracyclo[7.7.0.02,6.012,16]hexadeca-1(9),2(6),4,7,12(16)-pentaen-11-one
English name
3,4-dimethyl-9,10-dihydrocyclopenta[c]furo[2,3-f]chromen-7(8H)-one
Molecular formula
C16H14O3
Molecular weight
254.28

Names & synonyms

3,4-dimethyl-9,10-dihydrocyclopenta[c]furo[2,3-f]chromen-7(8H)-one374763-09-4Oprea1_044213STL456965AKOS001035710CCG-345165Z568041893,4-dimethyl-7,8,9,10-tetrahydrocyclopenta[c]furo[2,3-f]chromen-7-one3,4-dimethyl-9,10-dihydrocyclopenta[c]furo[2,3-f][1]benzopyran-7(8H)-one3,4-DIMETHYL-9,10-DIHYDRO-8H-1,6-DIOXA-DICYCLOPENTA(A,H)NAPHTHALEN-7-ONECyclopenta[c]furo[2,3-f][1]benzopyran-7(8H)-one, 9,10-dihydro-3,4-dimethyl-

Database identifiers

CAS
374763-09-4
PubChem CID
854571
EC Number
166-365-4

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
19
Formal charge
0
Complexity
453

Physicochemical properties

Boiling point
463 · 463.0±33.0 °C(Predicted)
Density
1.3 · 1.30±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 · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, 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 CategoriesAquatic Chronic 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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