1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-morpholinoethyl)-
Basic information
- CAS
30120-91-3- Standard SMILES
CCC(C)C(C=O)(CCN1CCOCC1)c1cccc2ccccc12- InChIKey
KTSCBFCEGKAJCX-UHFFFAOYSA-N- Molecular formula
- C22H29NO2
- Average molar mass
- 339.5 g/mol
- Monoisotopic mass
- 339.21982917
Names & identifiers
- Preferred name
- 1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-morpholinoethyl)-
- IUPAC
- 3-methyl-2-(2-morpholin-4-ylethyl)-2-naphthalen-1-ylpentanal
- English name
- α-(sec-Butyl)-α-(1-naphtyl)-4-morpholinebutanal
- Molecular formula
- C22H29NO2
- Molecular weight
- 339.47
Names & synonyms
BRN 122456230120-91-3alpha-sec-Butyl-alpha-(2-morpholinoethyl)-1-naphthaleneacetaldehyde1-Naphthaleneacetaldehyde, alpha-sec-butyl-alpha-(2-morpholinoethyl)-RefChem:232165DTXSID009525353-METHYL-2-[2-(MORPHOLIN-4-YL)ETHYL]-2-(NAPHTHALEN-1-YL)PENTANALalpha-(sec-Butyl)-alpha-(1-naphtyl)-4-morpholinebutanalα-(sec-Butyl)-α-(1-naphtyl)-4-morpholinebutanal4-Morpholinebutanal, α-(1-methylpropyl)-α-1-naphthalenyl-
Database identifiers
- CAS
30120-91-3- PubChem CID
- 207494
- DTXSID
DTXSID00952535- Nikkaji
- J41.818H
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 420
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Compound notes
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