Ethyl 6-methoxy-1-oxo-3-phenyl-1H-indene-2-carboxylate

HCID 23249734CAS 850209-49-3
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Basic information

Standard SMILES
CCOC(=O)C1=C(c2ccccc2)c2ccc(OC)cc2C1=O
InChIKey
DBMSEVNERSOURI-UHFFFAOYSA-N
Molecular formula
C19H16O4
Average molar mass
308.3 g/mol
Monoisotopic mass
308.10485899

Names & identifiers

Preferred name
Ethyl 6-methoxy-1-oxo-3-phenyl-1H-indene-2-carboxylate
IUPAC
ethyl 5-methoxy-3-oxo-1-phenylindene-2-carboxylate

Names & synonyms

850209-49-3DTXSID40631539Ethyl 6-methoxy-1-oxo-3-phenyl-1H-indene-2-carboxylateRefChem:344572DTXCID60582291CHEMBL2135476-methoxy-1-oxo-3-phenyl-1H-indene-2-carboxylic acid ethyl esterSCHEMBL3572575DBMSEVNERSOURI-UHFFFAOYSA-NBDBM50191605

Database identifiers

CAS
850209-49-3
PubChem CID
23249734
DTXSID
DTXSID40631539
ChEMBL
CHEMBL213547
Nikkaji
J2.150.444K

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
23

Related reactions

12 records
New reaction record

Linked notes

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