Summary

IMPPAT Phytochemical identifier: IMPHY008146

Phytochemical name: 1-Pentanol

Synonymous chemical names:
1-pentanol, amyl alcohol, amyl-alcohol, n-amylalcohol, pentan-1-ol

External chemical identifiers:
CID:6276, ChEMBL:CHEMBL14568, ChEBI:44884, ZINC:ZINC000001687154, FDASRS:M9L931X26Y, SureChEMBL:SCHEMBL10668, MolPort-001-783-728

---

Chemical structure information

SMILES:
CCCCCO

InChI:
InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3

InChIKey:
AMQJEAYHLZJPGS-UHFFFAOYSA-N

DeepSMILES:
CCCCCO

Functional groups:
CO

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.073

---

Chemical structure download