2-[9-(2-Hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]phenol
Basic information
- CAS
23285-18-9- Standard SMILES
Oc1ccccc1C1OCC2(CO1)COC(c1ccccc1O)OC2- InChIKey
QLEMXKCIAQLFMM-UHFFFAOYSA-N- Molecular formula
- C19H20O6
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.12598835
Names & identifiers
- Preferred name
- 2-[9-(2-Hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]phenol
- IUPAC
- 2-[3-(2-hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]phenol
Names & synonyms
23285-18-92-[9-(2-hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]phenol2,2'-(2,4,8,10-tetraoxaspiro[5.5]undecane-3,9-diyl)diphenolPhenol, 2,2'-(2,4,8,10-tetraoxaspiro[5.5]undecane-3,9-diyl)bis-2-[9-(2-hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undec-3-yl]phenolCBMicro_014476MLS000699025SCHEMBL6132290CHEMBL1407170DTXSID90353774HMS1615E11HMS2521A24
Show more names
SMSF0005068CCG-226092-[3-(2-hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]phenolAKOS001668738CB13230WAY-302018SMR000230532BIM-0014712.P001
Database identifiers
- CAS
23285-18-9- PubChem CID
- 752691
- DTXSID
DTXSID90353774- ChEMBL
CHEMBL1407170- Nikkaji
- J1.094.727H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 384
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Compound notes
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