Basic information
- CAS
42144-33-2- Standard SMILES
CCCCCCC(C)CC#N- InChIKey
FKZSSFLBNYYIDS-UHFFFAOYSA-N- Molecular formula
- C10H19N
- Average molar mass
- 153.26 g/mol
- Monoisotopic mass
- 153.15174961
Names & identifiers
- Preferred name
- 3-Methylnonanenitrile
- IUPAC
- 3-methylnonanenitrile
- English name
- 3-methylnonanenitrile
- Molecular formula
- C10H19N
- Molecular weight
- 153.26
Names & synonyms
3-Methylnonanenitrile42144-33-2EINECS 255-680-3DTXSID30962309RefChem:94935DTXCID101390118255-680-3Nonanenitrile, 3-methyl-3BZH67NNQ7SCHEMBL10526307FKZSSFLBNYYIDS-UHFFFAOYSA-NNS00056828
Database identifiers
- CAS
42144-33-2- PubChem CID
- 3016325
- DTXSID
DTXSID30962309- UNII
- 3BZH67NNQ7
- EC Number
- 255-680-3
- Nikkaji
- J278.343F
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 120
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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