Myristic acid - CAS 544-63-8

Catalog:	BB028683
Product Name:	Myristic acid
CAS:	544-63-8
Synonyms:	1-Tetradecanoic Acid; 1-Tridecanecarboxylic Acid; NSC 5028; N-Tetradecan-1-oic Acid; N-Tetradecanoic Acid; N-Tetradecoic Acid

Technical Data

IUPAC Name:	tetradecanoic acid
Description:	Myristic acid, a common saturated fatty acid found in nutmeg, palm kernel oil, coconut oil and butter fat, has been evaluated as a penetration enhancer in rat melatonin transdermal patches and bupropion preparations on human cadaver skin.
Molecular Weight:	228.37
Molecular Formula:	C14H28O2
Canonical SMILES:	CCCCCCCCCCCCCC(=O)O
InChI:	InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)
InChI Key:	TUNFSRHWOTWDNC-UHFFFAOYSA-N
Boiling Point:	326.20 °C (EPI 4.0)
Melting Point:	54-56°C
Flash Point:	144.8°C
Purity:	≥98%
Density:	0.898 g/cm³
Solubility:	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance:	White flakes
Storage:	Store at 2-8°C
Decomposition:	When heated to decomposition it emits acrid smoke and irritating fumes
MDL:	MFCD00002744
LogP:	4.77210
Refractive Index:	1.4305 (20°C)
Stability:	Stable. Incompatible with strong oxidizing agents, bases.
Vapor Pressure:	1 mmHg at 288 °F ; 5 mmHg at 345 °F; 760 mmHg at 604 °F

GHS Hazard Statement:	H315 (31.66%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P310, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, and P501
Signal Word:	Danger

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PMID	Publication Date	Title	Journal
33581636	20210415	Developmental exposures to perfluorooctanesulfonic acid (PFOS) impact embryonic nutrition, pancreatic morphology, and adiposity in the zebrafish, Danio rerio	Environmental pollution (Barking, Essex : 1987)
33352258	20210301	In vitro screening for chemical inhibition of the iodide recycling enzyme, iodotyrosine deiodinase	Toxicology in vitro : an international journal published in association with BIBRA
33096322	20201101	The specificity of asciminib, a potential treatment for chronic myeloid leukemia, as a myristate-pocket binding ABL inhibitor and analysis of its interactions with mutant forms of BCR-ABL1 kinase	Leukemia research
31721581	20200312	An Agonist Radioligand for the Proinflammatory Lipid-Activated G Protein-Coupled Receptor GPR84 Providing Structural Insights	Journal of medicinal chemistry
31638456	20191001	Presence of corneal crystals confirms an unusual presentation of Bietti's retinal dystrophy	Ophthalmic genetics

Complexity:	155
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	228.208930132
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	228.208930132
Rotatable Bond Count:	12
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.3