Triton X-100R.17

HCID 154735190
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Basic information

Standard SMILES
CC(C)(C)CC(C)(C)C1CCC(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)CC1
InChIKey
DKBJJIRPDNHGPJ-UHFFFAOYSA-N
Molecular formula
C48H96O18
Average molar mass
961.3 g/mol
Monoisotopic mass
960.65966623

Names & identifiers

Preferred name
Triton X-100R.17
IUPAC
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)cyclohexyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

Names & synonyms

Triton X-100R.17DTXSID40101842850-{[4-(2,4,4-Trimethylpentan-2-yl)cyclohexyl]oxy}-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48-hexadecaoxapentacontan-1-ol

Database identifiers

PubChem CID
154735190
DTXSID
DTXSID401018428

Properties

Computed structural properties

XLogP
2
Topological polar surface area
177 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
18
Rotatable bonds
54
Heavy atoms
66

Related reactions

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