1-(3,7,11,15-Tetramethylhexadecanoyl)pyrrolidine

HCID 574656

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Basic information

CAS: 56630-63-8
Standard SMILES: CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)N1CCCC1
InChIKey: KBENWCSBIJHQTR-UHFFFAOYSA-N
Molecular formula: C24H47NO
Average molar mass: 365.6 g/mol
Monoisotopic mass: 365.36576512

Names & identifiers

Preferred name: 1-(3,7,11,15-Tetramethylhexadecanoyl)pyrrolidine
IUPAC: 3,7,11,15-tetramethyl-1-pyrrolidin-1-ylhexadecan-1-one
English name: 1-(3,7,11,15-Tetramethylpalmitoyl)pyrrolidine
Molecular formula: C24H47NO
Molecular weight: 365.64

Names & synonyms

1-(3,7,11,15-Tetramethylhexadecanoyl)pyrrolidine56630-63-8DTXSID90341651RefChem:224113DTXCID10292732phytanic acid pyrrolididePyrrolidine, 1-(3,7,11,15-tetramethyl-1-oxohexadecyl)-KBENWCSBIJHQTR-UHFFFAOYSA-N3,7,11,15-tetramethyl-1-(pyrrolidin-1-yl)hexadecan-1-oneDB-2408061-(3,7,11,15-Tetramethylhexadecanoyl)pyrrolidine #3,7,11,15-Tetramethyl-1-(1-pyrrolidinyl)-1-hexadecanone

Show more names

1-(3,7,11,15-Tetramethylpalmitoyl)pyrrolidine1-Hexadecanone, 3,7,11,15-tetramethyl-1-(1-pyrrolidinyl)-

Database identifiers

CAS: 56630-63-8
PubChem CID: 574656
DTXSID: DTXSID90341651
Nikkaji: J108.651K

Properties

Computed structural properties

XLogP: 8.7
Topological polar surface area: 20.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 14
Heavy atoms: 26
Formal charge: 0
Complexity: 359

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