3-Methoxyacenaphthoquinone

HCID 2250264
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Basic information

Standard SMILES
COc1ccc2cccc3c2c1C(=O)C3=O
InChIKey
BGCFKMKBKIBZNU-UHFFFAOYSA-N
Molecular formula
C13H8O3
Average molar mass
212.2 g/mol
Monoisotopic mass
212.04734411

Names & identifiers

Preferred name
3-Methoxyacenaphthoquinone
IUPAC
3-methoxyacenaphthylene-1,2-dione

Names & synonyms

3-methoxyacenaphthoquinonemethoxyacenapthenquinoneSCHEMBL827965BGCFKMKBKIBZNU-UHFFFAOYSA-N3-methoxy-acenaphthene-1,2-dioneSR-01000213336SR-01000213336-1

Database identifiers

PubChem CID
2250264

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
16

Related reactions

3 records
New reaction record

Compound notes

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