Basic information
- CAS
69276-88-6- Standard SMILES
Oc1cc2c(cc1-c1cc3c(cc1O)OCO3)OCO2- InChIKey
LNOXWGDBXZCNET-UHFFFAOYSA-N- Molecular formula
- C14H10O6
- Average molar mass
- 274.22 g/mol
- Monoisotopic mass
- 274.04773803
Overview
See also: Sesame Oil (part of).
Names & identifiers
- Preferred name
- (5,5'-Bibenzo(D)(1,3)dioxole)-6,6'-diol
- IUPAC
- 6-(6-hydroxy-1,3-benzodioxol-5-yl)-1,3-benzodioxol-5-ol
Names & synonyms
JV7FA9J8BL(5,5'-Bibenzo(d)(1,3)dioxole)-6,6'-diol6-(6-HYDROXY-2H-1,3-BENZODIOXOL-5-YL)-2H-1,3-BENZODIOXOL-5-OLRefChem:25795NSC-35430869276-88-6UNII-JV7FA9J8BL(5,5'-Bi-1,3-benzodioxole)-6,6'-diolNSC354308SCHEMBL24434308DTXSID803200562H,2'H-[5,5'-Bi-1,3-benzodioxole]-6,6'-diol
Database identifiers
- CAS
69276-88-6- PubChem CID
- 337209
- DTXSID
DTXSID80320056- UNII
- JV7FA9J8BL
- Nikkaji
- J2.387.479B
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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