Basic information
- CAS
40762-37-6- Standard SMILES
C=CCOCCOCCC#N- InChIKey
RUDATSQJEJTDEW-UHFFFAOYSA-N- Molecular formula
- C8H13NO2
- Average molar mass
- 155.19 g/mol
- Monoisotopic mass
- 155.09462866
Names & identifiers
- Preferred name
- 3-[2-(Prop-2-en-1-yloxy)ethoxy]propanenitrile
- IUPAC
- 3-(2-prop-2-enoxyethoxy)propanenitrile
Names & synonyms
40762-37-63-[2-(prop-2-en-1-yloxy)ethoxy]propanenitrile3-(2-prop-2-enoxyethoxy)propanenitrileNSC13530SCHEMBL25560341DTXSID20279635NSC 13530NSC-13530DS-0137933-{2-[(Prop-2-en-1-yl)oxy]ethoxy}propanenitrile
Database identifiers
- CAS
40762-37-6- PubChem CID
- 224760
- DTXSID
DTXSID20279635
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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