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2,2,2-Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)acetamide

HCID 249384
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
6955-62-0
Standard SMILES
O=C(Nc1ccc2oc(=O)c3ccccc3c2c1)C(F)(F)F
InChIKey
XUKKGDUMWVJYEZ-UHFFFAOYSA-N
Molecular formula
C15H8F3NO3
Average molar mass
307.22 g/mol
Monoisotopic mass
307.0456276

Overview

2,2,2-Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)acetamide is a trifluoroacetamide and a benzochromenone.

Names & identifiers

Preferred name
2,2,2-Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)acetamide
IUPAC
2,2,2-trifluoro-N-(6-oxobenzo[c]chromen-2-yl)acetamide

Names & synonyms

6955-62-02,2,2-Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)acetamideNSC-67674FEX6E5463S2,2,2-trifluoro-n-(6-oxo-6h-benzo[c]chromen-2-yl)acetamide2,2,2-trifluoro-N-(6-oxobenzo[c]chromen-2-yl)acetamideUNII-FEX6E5463S6-(2,2,2-Trifluoroacetamido)-3,4-benzocoumarin2,2,2-Trifluoro-N-(6-oxo-6H-benzo(C)chromen-2-yl)acetamide2,2,2-trifluoro-N-{6-oxo-6H-benzo[c]chromen-2-yl}acetamideNCIOpen2_0084546-(2,2,2-Trifluoroacetamide)-3,4-benzocoumarin
Show more names
CHEBI:79895DTXSID30989531XUKKGDUMWVJYEZ-UHFFFAOYSA-NAKOS024337339Q27149049Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)ethanimidic acid2,2,2-Trifluoro-N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)ethanimidic acid

Database identifiers

CAS
6955-62-0
PubChem CID
249384
DTXSID
DTXSID30989531
ChEBI
CHEBI:79895
UNII
FEX6E5463S
Nikkaji
J2.794.336E

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
22
Formal charge
0
Complexity
465

Related reactions

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Compound notes

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