(RS)-2-(2-oxoethyl)-4-methoxy-1-indanone

HCID 10632007
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Basic information

Standard SMILES
COc1cccc2c1CC(CC=O)C2=O
InChIKey
KRSLFDPKPIPTQJ-UHFFFAOYSA-N
Molecular formula
C12H12O3
Average molar mass
204.22 g/mol

Names & identifiers

Preferred name
(RS)-2-(2-oxoethyl)-4-methoxy-1-indanone
IUPAC
2-(7-methoxy-3-oxo-1,2-dihydroinden-2-yl)acetaldehyde

Names & synonyms

SCHEMBL8597901KRSLFDPKPIPTQJ-UHFFFAOYSA-N(RS)-2-(2-oxoethyl)-4-methoxy-1-indanone

Database identifiers

PubChem CID
10632007

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Related reactions

3 records
New reaction record

Compound notes

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