Acetonitrile, m-toluidino-
Basic information
- CAS
28354-22-5- Standard SMILES
Cc1cccc(NCC#N)c1- InChIKey
MOQXGUQHBPOHDN-UHFFFAOYSA-N- Molecular formula
- C9H10N2
- Average molar mass
- 146.19 g/mol
- Monoisotopic mass
- 146.08439833
Names & identifiers
- Preferred name
- Acetonitrile, m-toluidino-
- IUPAC
- 2-(3-methylanilino)acetonitrile
- English name
- m-Toluidinoacetonitrile
- Molecular weight
- 0
Names & synonyms
ACETONITRILE, m-TOLUIDINO-m-TolylaminoacetonitrileAcetonitrile, m-tolylamino-28354-22-5BRN 2638752DTXSID60182598RefChem:316857DTXCID00105089m-Toluidinoacetonitrile(3-Methylanilino)acetonitrileSCHEMBL11269588AKOS000253442
Database identifiers
- CAS
28354-22-5- PubChem CID
- 34226
- DTXSID
DTXSID60182598- Nikkaji
- J90.705G
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 156
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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