Molecule record

3-propan-2-ylphenol

C9H12O

136.19 g/mol

Loading structure

Molecular properties

Formula
C9H12O
Molar mass
136.19 g·mol−1
Exact mass
136.0888 Da
4
PubChem CID
12059

Functional groups

Alkane / alkyl carbon
Aromatic ring
Phenol

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 210-551-0
  • 3-(1-Methylethyl)phenol
  • 3-(1-Methylethyl)phenol; Propofol Imp. F (EP); Propofol Impurity F
  • 3-Isopropylhydroxybenzene
  • 3-Isopropylphenol
  • 3-isopropyl-phenol
  • 618-45-1
  • AI3-18885
Show all 24 synonyms
  • BRN 2040880
  • DTXCID8024571
  • DTXSID0044571
  • EINECS 210-551-0
  • ERD00478GH
  • ISOPROPYLPHENOL, META
  • M-ISOPROPYLPHENOL
  • MFCD00002301
  • NSC-2209
  • Phenol, 3-(1-methylethyl)-
  • Phenol, m-isopropyl-
  • Propofol EP Impurity F
  • RefChem:911455
  • UNII-ERD00478GH
  • m-Cumenol
  • meta-isopropylphenol

Structure identifiers

Canonical SMILES
CC(C)c1cccc(O)c1
Isomeric SMILES
CC(C)C1=CC(=CC=C1)O
InChI
InChI=1S/C9H12O/c1-7(2)8-4-3-5-9(10)6-8/h3-7,10H,1-2H3
InChIKey
VLJSLTNSFSOYQR-UHFFFAOYSA-N
PubChem CID
12059

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 3-propan-2-ylphenol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-propan-2-ylphenol; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record
3-propan-2-ylphenol - Formula, Structure | ChemArche