Ether, (2-dimethylamino)ethyl p-nonylphenyl
Basic information
- CAS
63918-95-6- Standard SMILES
CCCCCCCCCc1ccc(OCCN(C)C)cc1- InChIKey
GHEDJSJWMBIQBZ-UHFFFAOYSA-N- Molecular formula
- C19H33NO
- Average molar mass
- 291.5 g/mol
- Monoisotopic mass
- 291.25621468
Names & identifiers
- Preferred name
- Ether, (2-dimethylamino)ethyl p-nonylphenyl
- IUPAC
- N,N-dimethyl-2-(4-nonylphenoxy)ethanamine
- English name
- (2-Dimethylaminoethyl)p-nonylphenyl ether
- Molecular formula
- C19H33NO
- Molecular weight
- 291.47
Names & synonyms
4-Nonylphenyl-beta-dimethylaminoethyl etherETHER, (2-DIMETHYLAMINO)ETHYL p-NONYLPHENYL63918-95-6DTXSID60213710RefChem:341520DTXCID90136201SCHEMBL28595265N,N-Dimethyl-2-(4-nonylphenoxy)ethan-1-amine(2-Dimethylaminoethyl)p-nonylphenyl etherEthanamine, N,N-dimethyl-2-(4-nonylphenoxy)-
Database identifiers
- CAS
63918-95-6- PubChem CID
- 45456
- DTXSID
DTXSID60213710- Nikkaji
- J92.997B
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Boiling point
- 386.1 · 386.1±25.0 °C(Predicted)
- Density
- 0.914 · 0.914±0.06 g/cm3(Predicted)
- pka
- 8.72 · 8.72±0.28(Predicted)
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Compound notes
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