Summary

IMPPAT Phytochemical identifier: IMPHY016467

Phytochemical name: 5,8-Diethyldodecane

Synonymous chemical names:
5,8-diethyl-dodecane

External chemical identifiers:
CID:520105, SureChEMBL:SCHEMBL524297

---

Chemical structure information

SMILES:
CCCCC(CCC(CCCC)CC)CC

InChI:
InChI=1S/C16H34/c1-5-9-11-15(7-3)13-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3

InChIKey:
DGQRNAPEPDFOEX-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCC))))CC)))))CC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.655

---

Chemical structure download