6-[3,5-Bis(methoxymethyl)-2,4,6-trimethylphenoxy]hexan-1-OL
Basic information
- CAS
823816-13-3- Standard SMILES
COCc1c(C)c(COC)c(C)c(OCCCCCCO)c1C- InChIKey
SJLOJPDOCDJYKM-UHFFFAOYSA-N- Molecular formula
- C19H32O4
- Average molar mass
- 324.5 g/mol
- Monoisotopic mass
- 324.2300595
Names & identifiers
- Preferred name
- 6-[3,5-Bis(methoxymethyl)-2,4,6-trimethylphenoxy]hexan-1-OL
- IUPAC
- 6-[3,5-bis(methoxymethyl)-2,4,6-trimethylphenoxy]hexan-1-ol
Names & synonyms
6-[3,5-BIS(METHOXYMETHYL)-2,4,6-TRIMETHYLPHENOXY]HEXAN-1-OL823816-13-3DTXSID60838043
Database identifiers
- CAS
823816-13-3- PubChem CID
- 71418751
- DTXSID
DTXSID60838043- Nikkaji
- J2.236.375A
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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