Basic information
- CAS
23417-34-7- Standard SMILES
Cc1ccccc1NC1=NCCO1- InChIKey
QLOGFFCTOGPFIU-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.09496301
Names & identifiers
- Preferred name
- o-Toluidine, N-(2-oxazolin-2-yl)-
- IUPAC
- N-(2-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
- English name
- 2-(2-Methylphenylimino)oxazolidine
- Molecular formula
- C10H12N2O
- Molecular weight
- 176.22
Names & synonyms
2-(o-Toluidino)-2-oxazolineo-Toluidine, N-(2-oxazolin-2-yl)-N-(2-Oxazolin-2-yl)toluidine23417-34-74,5-Dihydro-2-(o-methylphenylamino)oxazoleDTXSID00177968RefChem:366580DTXCID60100459N-(2-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amineCHEMBL390099SCHEMBL7047648N-(2-Oxazolin-2-yl)-o-toluidine
Show more names
2-(2-Methylphenylimino)oxazolidine2-Oxazolamine, 4,5-dihydro-N-(2-methylphenyl)-
Database identifiers
- CAS
23417-34-7- PubChem CID
- 211583
- DTXSID
DTXSID00177968- ChEMBL
CHEMBL390099- Nikkaji
- J85.101I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 203
Physicochemical properties
- Melting point
- 156 · 156-158 °C
- Boiling point
- 260.8 · 260.8±33.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- pka
- 7.3 · 7.30±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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