Molecular properties
- Formula
- C9H12
- Molar mass
- 120.19 g·mol−1
- Exact mass
- 120.0939 Da
- 4
- PubChem CID
- 7668
Molecule record
propylbenzene
C9H12
120.19 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 0WR86ZHG2Z
- 1-Phenylpropane
- 1-Propylbenzene
- 103-65-1
- 203-132-9
- Benzene, propyl-
- CHEBI:42630
- CHEMBL286062
Show all 24 synonyms
- DTXCID1022219
- DTXSID3042219
- EINECS 203-132-9
- HSDB 5353
- Isocumene
- MFCD00009377
- N-PROPYLBENZENE
- NSC-16941
- Phenylpropane
- Propyl-benzene
- Propylbenzene, analytical standard
- Propylbenzene, n-
- RefChem:6174
- UN2364
- benzene, propyl
- n-Propyl benzene
Structure identifiers
- Canonical SMILES
- CCCc1ccccc1
- Isomeric SMILES
- CCCC1=CC=CC=C1
- InChI
- InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3
- InChIKey
- ODLMAHJVESYWTB-UHFFFAOYSA-N
- PubChem CID
- 7668
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for propylbenzene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for propylbenzene; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.