4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol

HCID 52890

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Basic information

CAS: 74038-81-6
Standard SMILES: CCCCCCCCCC1=NC(C)(C)CN1CCO
InChIKey: LBXCABUUPOKOJP-UHFFFAOYSA-N
Molecular formula: C16H32N2O
Average molar mass: 268.44 g/mol
Monoisotopic mass: 268.25146365

Names & identifiers

Preferred name: 4,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanol
IUPAC: 2-(5,5-dimethyl-2-nonyl-4H-imidazol-3-yl)ethanol

Names & synonyms

74038-81-64,4-Dimethyl-2-nonyl-2-imidazoline-1-ethanolH95QZI3EXGNSC 177522-IMIDAZOLINE-1-ETHANOL, 4,4-DIMETHYL-2-NONYL-UNII-H95QZI3EXG1H-Imidazole-1-ethanol, 4,5-dihydro-4,4-dimethyl-2-nonyl-NSC-17752DTXSID00224901RefChem:198484DTXCID901473921H-Imidazole-1-ethanol, 4,5-dihydro-4,4-dimethyl-2-nonyl-(9CI)

Show more names

NSC17752WLN: T5N CN AUTJ B9 C2Q E1 E12-Imidazoline-1-ethanol,4-dimethyl-2-nonyl-1H-Imidazole-1-ethanol,5-dihydro-4,4-dimethyl-2-nonyl-2-(4,4-Dimethyl-2-nonyl-4,5-dihydro-1H-imidazol-1-yl)ethan-1-ol

Database identifiers

CAS: 74038-81-6
PubChem CID: 52890
DTXSID: DTXSID00224901
UNII: H95QZI3EXG

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 35.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 10
Heavy atoms: 19
Formal charge: 0
Complexity: 274

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