1-Naphthaleneacetaldehyde, alpha-(2-(diethylamino)ethyl)-alpha-isopropyl-
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Basic information
- CAS
30121-03-0- Standard SMILES
CCN(CC)CCC(C=O)(c1cccc2ccccc12)C(C)C- InChIKey
JWEUZDWBSXAJKG-UHFFFAOYSA-N- Molecular formula
- C21H29NO
- Average molar mass
- 311.5 g/mol
- Monoisotopic mass
- 311.22491455
Names & identifiers
- Preferred name
- 1-Naphthaleneacetaldehyde, alpha-(2-(diethylamino)ethyl)-alpha-isopropyl-
- IUPAC
- 2-[2-(diethylamino)ethyl]-3-methyl-2-naphthalen-1-ylbutanal
- English name
- 2-(2-diethylaminoethyl)-3-methyl-2-naphthalen-1-yl-butanal
- Molecular formula
- C21H29NO
- Molecular weight
- 311.46
Names & synonyms
30121-03-0BRN 2148824alpha-(2-(Diethylamino)ethyl)-alpha-isopropyl-1-naphthaleneacetaldehyde1-Naphthaleneacetaldehyde, alpha-(2-(diethylamino)ethyl)-alpha-isopropyl-RefChem:232157DTXSID409525392-[2-(DIETHYLAMINO)ETHYL]-3-METHYL-2-(NAPHTHALEN-1-YL)BUTANAL2-(2-DIETHYLAMINOETHYL)-3-METHYL-2-NAPHTHALEN-1-YL-BUTANALα-[2-(Diethylamino)ethyl]-α-isopropyl-1-naphthaleneacetaldehyde1-Naphthaleneacetaldehyde, α-[2-(diethylamino)ethyl]-α-(1-methylethyl)-
Database identifiers
- CAS
30121-03-0- PubChem CID
- 207498
- DTXSID
DTXSID40952539- Nikkaji
- J42.347E
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
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Compound notes
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