lauryl stearate - CAS 5303-25-3

Catalog:	BB028019
Product Name:	lauryl stearate
CAS:	5303-25-3
Synonyms:	dodecyl octadecanoate

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Computed Properties

IUPAC Name:	dodecyl octadecanoate
Description:	lauryl stearate (CAS# 5303-25-3 ) is a useful research chemical.
Molecular Weight:	452.80
Molecular Formula:	C30H60O2
Canonical SMILES:	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC
InChI:	InChI=1S/C30H60O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30(31)32-29-27-25-23-21-14-12-10-8-6-4-2/h3-29H2,1-2H3
InChI Key:	JRTVEUGOGWTHTR-UHFFFAOYSA-N
Boiling Point:	484.9 °C at 760 mmHg
Melting Point:	41°C
Flash Point:	255.5°C
Density:	0.858 g/cm³
Solubility:	water, 3.259e-009 mg/L @ 25 °C (est)
Appearance:	White to almost white powder to crystal
MDL:	MFCD00059290
LogP:	10.71200
Refractive Index:	1.711

Publication Number	Title	Priority Date
US-2021128531-A1	Stable composition including angiotensin ii, preparation method and application method thereof	20191031
US-2021079249-A1	Precoat liquid, image forming method using the precoat liquid, and image forming apparatus using the precoat liquid	20190917
WO-2021033399-A1	Chlorine-containing resin composition and molded product thereof	20190821
US-2021023576-A1	Process for Seaming of Artificial Turf using Low-Pressure Adhesives	20190724
WO-2021001937-A1	Thermally curable ink-jet ink	20190702

PMID	Publication Date	Title	Journal
21533136	20110420	Simultaneously hermaphroditic shrimp use lipophilic cuticular hydrocarbons as contact sex pheromones	PloS one

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Complexity:	353
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	452.45933115
Formal Charge:	0
Heavy Atom Count:	32
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	452.45933115
Rotatable Bond Count:	28
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	14.1