Triton X-100R.8

HCID 4194507
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Basic information

Standard SMILES
CC(C)(C)CC(C)(C)C1CCC(OCCOCCOCCOCCOCCOCCOCCOCCO)CC1
InChIKey
LVHZSSVOODJLAY-UHFFFAOYSA-N
Molecular formula
C30H60O9
Average molar mass
564.8 g/mol
Monoisotopic mass
564.4237335

Names & identifiers

Preferred name
Triton X-100R.8
IUPAC
2-[2-[2-[2-[2-[2-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)cyclohexyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Names & synonyms

Triton X-100R.8SCHEMBL17493142DTXSID00101841423-{[4-(2,4,4-Trimethylpentan-2-yl)cyclohexyl]oxy}-3,6,9,12,15,18,21-heptaoxatricosan-1-ol

Database identifiers

PubChem CID
4194507
DTXSID
DTXSID001018414

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
94.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
27
Heavy atoms
39

Related reactions

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