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isopropyl stearate - 98%, high purity , CAS No.112-10-7

COA

Grade & Purity:

≥98%

Cas Number: 112-10-7
Molecular Weight: 326.56
PubChem CID: 8162

In stock

Item Number

I302217

Grouped product items
SKU	Size	Availability	Price
I302217-10ml	10ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$68.90
I302217-50ml	50ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$202.90
I302217-250ml	250ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$807.90

Basic Description

Synonyms	Octadecanoic acid, 1-methylethyl ester \| 1-Methylethyl octadecanoate \| ISOPROPYL STEARATE \| Stearic acid, isopropyl ester \| EINECS 203-934-9 \| FT-0631637 \| Wickenol 127 \| Tegosoft S \| Octadecanoic acid,1-methylethyl ester \| BRN 1791443 \| Isopropyl octadec
Specifications & Purity	≥98%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Fatty Acyls
    - Subclass Fatty acid esters

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Fatty Acyls
Subclass	Fatty acid esters
Intermediate Tree Nodes	Not available
Direct Parent	Fatty acid esters
Alternative Parents	Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Fatty acid ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	propan-2-yl octadecanoate
INCHI	InChI=1S/C21H42O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(2)3/h20H,4-19H2,1-3H3
InChIKey	ZPWFUIUNWDIYCJ-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCCCCCC(=O)OC(C)C
Isomeric SMILES	CCCCCCCCCCCCCCCCCC(=O)OC(C)C
Molecular Weight	326.56
Reaxy-Rn	1791443
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1791443&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Refractive Index	1.4325 (estimate)
Flash Point(°C)	179.3ºC
Boil Point(°C)	368.2ºC at 760mmHg
Melt Point(°C)	28°C
Molecular Weight	326.600 g/mol
XLogP3	9.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	18
Exact Mass	326.318 Da
Monoisotopic Mass	326.318 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	248.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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