Basic information
- CAS
2473-16-7- Standard SMILES
O=C1C=C(O)c2c(O)cc(O)c(O)c2C1=O- InChIKey
PEEIVTDTCNXCLB-UHFFFAOYSA-N- Molecular formula
- C10H6O6
- Average molar mass
- 222.15 g/mol
- Monoisotopic mass
- 222.01643791
Overview
4,5,7,8-Tetrahydroxynaphthalene-1,2-dione has been reported in Helicobasidium mompa with data available.
Names & identifiers
- Preferred name
- 4,5,7,8-Tetrahydroxynaphthalene-1,2-dione
- IUPAC
- 4,5,7,8-tetrahydroxynaphthalene-1,2-dione
- English name
- 2,5,7,8-Tetrahydroxy-1,4-naphthoquinone
- Molecular formula
- C10H6O6
- Molecular weight
- 222.15
Names & synonyms
4,5,7,8-tetrahydroxynaphthalene-1,2-dioneDTXSID80947661RefChem:1069366DTXCID5013759182473-16-7Mompain2,5,7,8-Tetrahydroxy-1,4-naphthalenedione1,4-Naphthalenedione, 2,5,7,8-tetrahydroxy-2,5,7,8-tetrahydroxy-1,4-naphthoquinone2,7-Dihydroxynaphthazarin1,4-Naphthoquinone, 2,5,7,8-tetrahydroxy-SCHEMBL5820321
Show more names
CHEMBL1544492CHEMBL1986342SCHEMBL29890808DBSNTEVHAJLWOY-UHFFFAOYSA-NHMS2270H132,5,7,8-Tetrahydroxynaphthoquinone #NCGC00247585-01
Database identifiers
- CAS
2473-16-7- PubChem CID
- 75583
- DTXSID
DTXSID80947661- ChEMBL
CHEMBL1544492、CHEMBL1986342- Nikkaji
- J13.277B
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 374
Chemistry & industry
Applications
Uses2,5,7,8-Tetrahydroxy-1,4-Naphthalenedione have been synthesized and studied for antimicrobial and antifungal activities.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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