16-Hexadecanolide

Product Information

Molecular Formula:
C16H30O2
Molecular Weight:
254.41
Description
16-Hexadecanolide (CAS# 109-29-5) is a useful synthetic reagent used to prepare long chain fatty alcohols.
Synonyms
oxacycloheptadecan-2-one
IUPAC Name
oxacycloheptadecan-2-one
Canonical SMILES
C1CCCCCCCC(=O)OCCCCCCC1
InChI
InChI=1S/C16H30O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h1-15H2
InChI Key
LOKPJYNMYCVCRM-UHFFFAOYSA-N
Boiling Point
188 °C / 15 mmHg
Melting Point
34-38 °C (lit.)
Flash Point
>100°C
Purity
95 %
Density
0.94 g/cm3
Appearance
Colourless to light yellow solid
Storage
-20 °C
Refractive Index
n20/D1.4680-1.4730
Stability
Stable. Combustible. Incompatible with strong oxidizing agents.
LogP
5.00460

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word
Warning

Computed Properties

XLogP3
6.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
254.224580195 g/mol
Monoisotopic Mass
254.224580195 g/mol
Topological Polar Surface Area
26.3Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
201
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-2022031761-A How to improve the solubility of poorly water-soluble ingredients 2021-11-22
CN-113588840-A Method for detecting content of milbemycins 2021-08-17
CN-113122122-A High-solid-content polyurethane ink resin, preparation method and application thereof 2021-04-02
CN-112931401-A Crossbreeding method for improving growth performance of Jian red-hair duck 2021-03-05
DE-202021100549-U1 Device for the release of volatile substances into the environment 2021-02-03
CN-112868647-A Application of perfume compound in preparation of sanitary articles for inhibiting infection of novel coronavirus 2021-01-21
KR-102242940-B1 Method for preparing a non-reducing cleaning composition containing vegetable extracts and a non-reducing cleaning composition prepared thereby 2021-01-19
CN-112390810-A Separation and purification method of milbemycin fermentation liquor 2020-11-26
CN-112390810-B Separation and purification method of milbemycin fermentation liquor 2020-11-26
CN-112225873-A High-transparency fast-forming degradable thermoplastic polyurethane elastomer and preparation method thereof 2020-09-15

Literatures

PMID Publication Date Title Journal
21802479 2011-12-01 Fragrance material review on hexadecanolide Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association
18975906 2008-12-01 Polymers from functional macrolactones as potential biomaterials: enzymatic ring opening polymerization, biodegradation, and biocompatibility Biomacromolecules
17914582 2007-11-01 Antitumor and anti-invasive effects of diverse new macrocyclic lactones, alkylolides and alkenylolides, and their enhancement by hyperthermia Oncology reports
17191826 2004-12-01 14-Methylpentadecano-15-lactone (muscolide): a new macrocyclic lactone from the oil of Angelica archangelica L Chemistry & biodiversity
11807759 2002-03-20 A comparison of lipase-catalysed ester and lactone synthesis in low-water systems: analysis of optimum water activity Biotechnology and bioengineering
11735540 2001-12-14 Stereoselective synthesis of delta-lactones from 5-oxoalkanals via one-pot sequential acetalization, Tishchenko reaction, and lactonization by cooperative catalysis of samarium Ion and mercaptan The Journal of organic chemistry
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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