6,7-Dichloro-2,3-dihydro-5-methoxy-2-propyl-1H-inden-1-one

HCID 13613323
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Basic information

Standard SMILES
CCCC1Cc2cc(OC)c(Cl)c(Cl)c2C1=O
InChIKey
KEYZKMOXUHOLFP-UHFFFAOYSA-N
Molecular formula
C13H14Cl2O2
Average molar mass
273.15 g/mol

Names & identifiers

Preferred name
6,7-Dichloro-2,3-dihydro-5-methoxy-2-propyl-1H-inden-1-one
IUPAC
6,7-dichloro-5-methoxy-2-propyl-2,3-dihydroinden-1-one

Names & synonyms

SCHEMBL10493480KEYZKMOXUHOLFP-UHFFFAOYSA-N6,7-Dichloro-2,3-dihydro-5-methoxy-2-propyl-1H-inden-1-one

Database identifiers

PubChem CID
13613323
Nikkaji
J2.337.210J

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17

Related reactions

3 records
New reaction record

Linked notes

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