Basic information
- CAS
2928-69-0- Standard SMILES
CCC(C)C(C#N)(CCN1CCOCC1)c1ccccc1- InChIKey
KUSPAVYMGQSRFN-UHFFFAOYSA-N- Molecular formula
- C18H26N2O
- Average molar mass
- 286.4 g/mol
- Monoisotopic mass
- 286.20451346
Names & identifiers
- Preferred name
- Valeronitrile, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-
- IUPAC
- 3-methyl-2-(2-morpholin-4-ylethyl)-2-phenylpentanenitrile
- English name
- 3-Methyl-2-(2-morpholinoethyl)-2-phenylvaleronitrile
- Molecular weight
- 0
Names & synonyms
BRN 10822563-Methyl-2-(2-morpholinoethyl)-2-phenylvaleronitrile2928-69-0Valeronitrile, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-RefChem:388303DTXSID409518653-METHYL-2-[2-(MORPHOLIN-4-YL)ETHYL]-2-PHENYLPENTANENITRILE
Database identifiers
- CAS
2928-69-0- PubChem CID
- 200909
- DTXSID
DTXSID40951865- Nikkaji
- J96.716E
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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