4-acetyl-9a-butyl-8-chloro-7-methoxy-1,2,9,9a-tetrahydro-3H-fluoren-3-one

HCID 21990879
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Basic information

Standard SMILES
CCCCC12CCC(=O)C(C(C)=O)=C1c1ccc(OC)c(Cl)c1C2
InChIKey
ZQRLUYLKOZCLJI-UHFFFAOYSA-N
Molecular formula
C20H23ClO3
Average molar mass
346.8 g/mol

Names & identifiers

Preferred name
4-acetyl-9a-butyl-8-chloro-7-methoxy-1,2,9,9a-tetrahydro-3H-fluoren-3-one
IUPAC
4-acetyl-9a-butyl-8-chloro-7-methoxy-2,9-dihydro-1H-fluoren-3-one

Names & synonyms

SCHEMBL2420132ZQRLUYLKOZCLJI-UHFFFAOYSA-N4-acetyl-9a-butyl-8-chloro-7-methoxy-1,2,9,9a-tetrahydro-3H-fluoren-3-one

Database identifiers

PubChem CID
21990879

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
24

Related reactions

4 records
New reaction record

Compound notes

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