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N-Octadecylurea - >97.0%(N), high purity , CAS No.2158-08-9

COA

Grade & Purity:

≥97%(N)

Cas Number: 2158-08-9
Molecular Weight: 312.54
Beilstein Registry Number: 4(3)438
MDL number: MFCD00043623
PubChem CID: 75090
PubChem SID: 504754905

In stock

Item Number

N159528

Grouped product items
SKU	Size	Availability	Price	Qty
N159528-1g	1g	3	$17.90
N159528-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$133.90

View related series

Non heterocyclic block (8163) ureas (94)

Basic Description

Synonyms	DTXSID9062221 \| FT-0676052 \| EINECS 218-477-0 \| N-Octadecylurea, AldrichCPR \| Octadecylurea \| stearylurea \| O0209 \| GJNDMSSZEBNLPU-UHFFFAOYSA-N \| SCHEMBL947042 \| NSC16075 \| NSC-16075 \| N-Stearylurea \| T72081 \| KT35TVW7Q2 \| 1-Octadecylurea \| MFCD00043623 \|
Specifications & Purity	≥97%(N)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Organic carbonic acids and derivatives
    - Subclass Ureas

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Organic carbonic acids and derivatives
Subclass	Ureas
Intermediate Tree Nodes	Not available
Direct Parent	Ureas
Alternative Parents	Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Urea - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as ureas. These are compounds containing two amine groups joined by a carbonyl (C=O) functional group.
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

Pubchem Sid	504754905
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754905
IUPAC Name	octadecylurea
INCHI	InChI=1S/C19H40N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19(20)22/h2-18H2,1H3,(H3,20,21,22)
InChIKey	GJNDMSSZEBNLPU-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCCCCCCNC(=O)N
Isomeric SMILES	CCCCCCCCCCCCCCCCCCNC(=O)N
Molecular Weight	312.54
Beilstein	4(3)438
Reaxy-Rn	1791225
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1791225&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
C2421564	Certificate of Analysis	Feb 19, 2024	N159528
C2421565	Certificate of Analysis	Feb 19, 2024	N159528
B2418376	Certificate of Analysis	Jan 27, 2024	N159528

Chemical and Physical Properties

Melt Point(°C)	110 °C
Molecular Weight	312.500 g/mol
XLogP3	7.800
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	17
Exact Mass	312.314 Da
Monoisotopic Mass	312.314 Da
Topological Polar Surface Area	55.100 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	231.000
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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