1,9-Nonanediol
Product Information
Molecular Formula
C9H20O2
Molecular Weight
160.25
Description
1,9-Nonanediol (CAS# 3937-56-2) is found to be a general anesthetic that can inhibit the firefly luciferase enzyme from Photinus pyralis by competing with its normal substrate firefly luciferin. 1,9-Nonanediol can also inhibit the bacterial luciferase enzyme from Vibrio Harveyi by competing with the substrate n-decanal.
Synonyms
nonane-1,9-diol
IUPAC Name
nonane-1,9-diol
SMILES
C(CCCCO)CCCCO
InChI
InChI=1S/C9H20O2/c10-8-6-4-2-1-3-5-7-9-11/h10-11H,1-9H2
InChI Key
ALVZNPYWJMLXKV-UHFFFAOYSA-N
Boiling Point
171 °C / 20 mmHg
Melting Point
46 °C
Flash Point
235.4 °CF
Purity
> 98.0 % (GC)
Density
0.95 g/cm3
Appearance
White to almost white powder to crystal
LogP
1.70170
Safety Information
Precautionary Statement
P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
2.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
8
Exact Mass
160.146329876 g/mol
Monoisotopic Mass
160.146329876 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
56.6
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022043345-A | Carrier for static charge image development, static charge image developer, process cartridge, image forming apparatus, and image forming method | 2022-01-14 |
| JP-2022040236-A | Packaging materials and products | 2022-01-07 |
| JP-2022040177-A | Electronic component mounting boards and electronic devices | 2021-12-24 |
| JP-2022027992-A | Wiring board and its manufacturing method | 2021-12-20 |
| CN-114028470-A | Novel extraction method of polyphenol in rambutan peel | 2021-12-15 |
| CN-114129483-A | Essence containing rambutan peel polyphenol and milk protein and preparation method thereof | 2021-12-15 |
| CN-114163603-A | Polyurethane microporous elastomer and preparation method and application thereof | 2021-12-13 |
| JP-2022031343-A | Photo-curing nail dressing | 2021-12-13 |
| JP-2022027803-A | Moisture-curable one-component adhesive composition and laminate | 2021-11-29 |
| JP-2022028891-A | Packaging materials and products | 2021-11-29 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22113370 | 2011-11-01 | Identification and field evaluation of sex pheromone components of the pear barkminer moth, Spulerina astaurota | Journal of chemical ecology |
| 20232886 | 2010-04-12 | Functional thermoplastics from linear diols and diisocyanates produced entirely from renewable lipid sources | Biomacromolecules |
| 20131900 | 2010-03-03 | Iridium-catalyzed alpha-alkylation of acetates with primary alcohols and diols | Journal of the American Chemical Society |
| 19265385 | 2009-04-01 | Automated potentiometric titrations in KCl/water-saturated octanol: method for quantifying factors influencing ion-pair partitioning | Analytical chemistry |
| 19521918 | 2009-01-01 | New synthesis of nematocidal natural products dithiocynates thiocyanatin A and 1,8,16-trihydroxyhexadecane | Natural product research |
| 17566337 | 2007-05-01 | Potential sources of background contaminants in solid phase extraction and microextraction | Journal of separation science |
| 16495670 | 2006-02-01 | Synthesis and characterization of 3,13- and 2,13-octadecadienyl compounds for identification of the sex pheromone secreted by a clearwing moth, Nokona pernix | Bioscience, biotechnology, and biochemistry |
| 16398489 | 2006-01-01 | Polycondensation of dicarboxylic acids and diols in water catalyzed by surfactant-combined catalysts and successive chain extension | Biomacromolecules |
| 14758017 | 2004-02-01 | Simple synthesis of beta-D-glycopyranosides using beta-glycosidase from almonds | Chemical & pharmaceutical bulletin |
