Molecular properties
- Formula
- C8H10
- Molar mass
- 106.16 g·mol−1
- Exact mass
- 106.0783 Da
- 4
- 0
- 0
- 0.00 Ų
- 3.1 (PubChem computed XLogP3-AA descriptor)
- CAS
- 95-47-6
- PubChem CID
- 7237
Molecule record
O-XYLENE
C8H10
106.16 g/mol
Interactions
- Polarity
- Often weakly polar or nonpolar unless other structural features dominate.
- Acid-base behavior
- Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
- Intermolecular forces
- Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.
Functional groups
Alkene
Aromatic ring
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 3.1 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1,2-Dimethylbenzene
- 1,2-Dimethylbenzol
- 1,2-Xylene
- 2-Methyltoluene
- 2-Xylene
- 202-422-2
- 3,4-Xylene
- 95-47-6
Show all 22 synonyms
- Benzene, 1,2-dimethyl-
- CHEBI:28063
- DTXCID501807
- DTXSID3021807
- NSC-60920
- Ortho-Xylene
- RefChem:97
- Xylene, o-
- Z2474E14QP
- o-Dimethylbenzene
- o-Methyltoluene
- o-Xylenes
- o-Xylol
- orthoxylene
Structure identifiers
- Canonical SMILES
- CC1=CC=CC=C1C
- Isomeric SMILES
- CC1=CC=CC=C1C
- InChI
- InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3
- InChIKey
- CTQNGGLPUBDAKN-UHFFFAOYSA-N
- PubChem CID
- 7237
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
Simulated FTIR trace
Predicted FTIR / %T
4 cm-1 resolution / deterministic instrument profile
Hover for cursor
Peak assignments
1645 cm−1C=C alkene (simulated)
3030 cm−1aromatic C-H (simulated)
1600 cm−1aromatic C=C (simulated)
2960 cm−1sp3 C-H (simulated)
Simulated NMR
On-demand educational prediction for O-XYLENE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for O-XYLENE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.
simulated IR
ChemForge original educational simulation.