9-Octadecenoic acid

9-Octadecenoic acid
Compound Structure:
Synonyms: 9-octadecenoic acid;Octadec-9-enoic acid
Compound ID: NMPC-072
PubChem ID:

965

Molecular Formula: C18H34O2
Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)O
InChIKey: ZQPPMHVWECSIRJ-UHFFFAOYSA-N
About the compound:

Oleic acid is a naturally occurring fatty acid present in a variety of animal and vegetable fats and oils. It is a colorless, odorless liquid, though commercial samples may have a slightly yellowish tint. From a chemical perspective, oleic acid falls into the category of monounsaturated omega-9 fatty acids and is represented by the lipid notation 18:1 cis-9. It is a primary product of Δ9-desaturase. Its chemical formula is CH3−(CH2)7−CH=CH−(CH2)7−COOH. The name "oleic" is derived from the Latin word "oleum," which means oil. This fatty acid is the most prevalent and common one found in nature. Oleic acid's salts and esters are known as oleates, and it is an ingredient in many oils, making it a common component in artificial food products and soaps. 9-Octadecenoic acid, which is another name for oleic acid, can be found naturally in Eleutherococcussessiliflorus, Dipteryxlacunifera, and various other sources. It is an unsaturated fatty acid and is the most widely distributed and abundant fatty acid in nature. Commercially, it is utilized in the formulation of oleates and lotions, and it serves as a pharmaceutical solvent.

Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

282.5 g/mol

XLogP3

6.5

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

15

Exact Mass

282.255880323 g/mol

Monoisotopic Mass

282.255880323 g/mol

Topological Polar Surface Area

37.3Ų

Heavy Atom Count

20

Formal Charge

0

Complexity

234

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

1

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Boiling Point

360 °C (680 °F; 633 K)

Melting Point

13 to 14 °C (55 to 57 °F; 286 to 287 K)

Density

0.895 g/mL

Source: PubChem

Source Species: Chrysophyllum albidum
Colocasia esculenta
Costus afer
Curculigo pilosa
Ficus exasperata
Gouania longipetala
Piper guineense
Saccharum officinarum
Urena lobata
Vernonia colorata
Irvingia gabonensis.
Strychnos innocua
Azanza garckeana
Moringa oleifera
Erythrina senegalensis
Morinda lucida
Pyrenacantha staudtii
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