Basic information
- CAS
63755-81-7- Standard SMILES
CC1OC2=C(C(=O)c3ccccc3C2=O)C(O)C1O- InChIKey
ULUGVKRCRLDUQY-UHFFFAOYSA-N- Molecular formula
- C14H12O5
- Average molar mass
- 260.24 g/mol
- Monoisotopic mass
- 260.06847348
Names & identifiers
- Preferred name
- 3,4-Dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
- IUPAC
- 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
Names & synonyms
NSC29758763813-74-163755-81-7NSC2972863,4-Dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dioneDTXSID80980275ULUGVKRCRLDUQY-UHFFFAOYSA-NNSC-297286NSC-2975872H-Naphtho[2,3-b]pyran-5,10-dione der.3,4-Dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione #3,4-Dihydroxy-2-methyl-3,4-dihydro-2H-naphtho[2,3-b]pyran-5,10-dione
Show more names
2H-Naphtho[2,10-dione, 3,4-dihydro-3,4-dihydroxy-2-methyl-, (2.alpha.,3.beta.,4.beta.)-2H-Naphtho[2,3-b]furan-5,10-dione, 3,4-dihydro-3,4-dihydroxy-2-methyl-, [2S-(2.alpha.,3.alpha.,4.alpha.)]-
Database identifiers
- CAS
63755-81-7、63813-74-1- PubChem CID
- 326258
- DTXSID
DTXSID80980275
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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