Summary

IMPPAT Phytochemical identifier: IMPHY001215

Phytochemical name: Propanol

Synonymous chemical names:
1-propanol, propan-1-ol, propanol, propyl alcohol, propyl alcohol

External chemical identifiers:
CID:1031, ChEMBL:CHEMBL14687, ChEBI:28831, ZINC:ZINC000000895969, FDASRS:96F264O9SV, SureChEMBL:SCHEMBL1478, MolPort-000-872-058

---

Chemical structure information

SMILES:
CCCO

InChI:
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3

InChIKey:
BDERNNFJNOPAEC-UHFFFAOYSA-N

DeepSMILES:
CCCO

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: 0.672

---

Chemical structure download