Basic information
- CAS
65536-43-8- Standard SMILES
Cc1cccc(NC2=NCCO2)c1- InChIKey
MKENSKQNBRWBOI-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.09496301
Names & identifiers
- Preferred name
- 2-Oxazolamine, 4,5-dihydro-N-(3-methylphenyl)-
- IUPAC
- N-(3-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
2-(m-Toluidino)-2-oxazoline65536-43-82-Oxazolamine, 4,5-dihydro-N-(3-methylphenyl)-BRN 1103182m-Toluidine, N-(2-oxazolin-2-yl)-DTXSID90215828NSC 162352RefChem:264582DTXCID201383192-Oxazolamine, 4,5-dihydro-N-(3-methylphenyl)-(9CI)N-(3-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amineNSC162352
Show more names
2-Oxazolamine, 4,5-dihydro-N-(3-methylphenyl)- (9CI)CHEMBL225904SCHEMBL11685491NSC-162352DB-338653
Database identifiers
- CAS
65536-43-8- PubChem CID
- 98733
- DTXSID
DTXSID90215828- ChEMBL
CHEMBL225904- Nikkaji
- J85.100K
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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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