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Catalog Number | ACM127514629 |
CAS Number | 127514-62-9 |
Synonyms | Hydroxyl-γ-isosanshool |
Molecular Weight | 289.4 |
InChI | InChI=1S/C18H27NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(2,3)21/h4-9,12-15,21H,10-11,16H2,1-3H3,(H,19,20)/b5-4+,7-6+,9-8+,13-12+,15-14+ |
InChI Key | CRPPMKFSMRODIQ-FMBIJHKPSA-N |
Purity | 95%+ |
Complexity | 427 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Exact Mass | 289.204179104 |
Heavy Atom Count | 21 |
Hydrogen Bond Acceptor Count | 2 |
Hydrogen Bond Donor Count | 2 |
Isomeric SMILES | C/C=C/C=C/C=C/CC/C=C/C=C/C(=O)NCC(C)(C)O |
Monoisotopic Mass | 289.204179104 |
PhysicalState | Powder |
Rotatable Bond Count | 9 |
Topological Polar Surface Area | 49.3 Ų |
What is the chemical name of hydroxyl-γ-isosanshool?
The chemical name is N-(2-hydroxyisobutyl)-2,4,8,10,12-tetradecapentaenamide.
What are synonyms for hydroxyl-γ-isosanshool?
Synonyms include Hydroxy-Gamma-Isosanshool.
What is the CAS number for hydroxyl-γ-isosanshool?
The CAS number is 127514-62-9.
What is the molecular formula of hydroxyl-γ-isosanshool?
The molecular formula is C18H27NO2.
What is the molecular weight of hydroxyl-γ-isosanshool?
The molecular weight is 289.41.
What is the predicted boiling point of hydroxyl-γ-isosanshool?
The predicted boiling point is 505.9±50.0 °C.
What is the predicted density of hydroxyl-γ-isosanshool?
The predicted density is 0.973±0.06 g/cm3.
What is the predicted pka value of hydroxyl-γ-isosanshool?
The predicted pka value is 14.55±0.29.
How is hydroxyl-γ-isosanshool defined in ChEBI?
It is defined as N-(2-Hydroxyisobutyl)-2,4,8,10,12-tetradecapentaenamide is a fatty amide.
What is the chemical structure of hydroxyl-γ-isosanshool?
The chemical structure is (2E,4E,8E,10E,12E)-N-(2-hydroxy-2-methylpropyl)-2,4,8,10,12-Tetradecapentaenamide.
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