1-Naphthaleneacetonitrile, alpha-(2-(dimethylamino)ethyl)-alpha-methyl-
Basic information
- CAS
2572-88-5- Standard SMILES
CN(C)CCC(C)(C#N)c1cccc2ccccc12- InChIKey
HGLDREUVVOSRSX-UHFFFAOYSA-N- Molecular formula
- C17H20N2
- Average molar mass
- 252.35 g/mol
- Monoisotopic mass
- 252.16264865
Names & identifiers
- Preferred name
- 1-Naphthaleneacetonitrile, alpha-(2-(dimethylamino)ethyl)-alpha-methyl-
- IUPAC
- 4-(dimethylamino)-2-methyl-2-naphthalen-1-ylbutanenitrile
- English name
- 1-NAPHTHALENEACETONITRILE, alpha-(2-(DIMETHYLAMINO)ETHYL)-alpha-METHYL -
- Molecular formula
- C17H20N2
- Molecular weight
- 252.35
Names & synonyms
2572-88-51-NAPHTHALENEACETONITRILE, alpha-(2-(DIMETHYLAMINO)ETHYL)-alpha-METHYL-RefChem:1055955BRN 2136842alpha-(2-(Dimethylamino)ethyl)-alpha-methyl-1-naphthaleneacetonitrileDTXSID909486044-(DIMETHYLAMINO)-2-METHYL-2-(NAPHTHALEN-1-YL)BUTANENITRILEα-[2-(Dimethylamino)ethyl]-α-methyl-1-naphthaleneacetonitrile1-Naphthaleneacetonitrile, α-[2-(dimethylamino)ethyl]-α-methyl-1-NAPHTHALENEACETONITRILE, alpha-(2-(DIMETHYLAMINO)ETHYL)-alpha-METHYL -
Database identifiers
- CAS
2572-88-5- PubChem CID
- 17398
- DTXSID
DTXSID90948604- Nikkaji
- J42.406D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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