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1,3-Diallylurea - >98.0%(GC), high purity , CAS No.1801-72-5

COA

Grade & Purity:

≥98%(GC)

Cas Number: 1801-72-5
Molecular Weight: 140.19
MDL number: MFCD00008639
PubChem CID: 74537

In stock

Item Number

D155384

Grouped product items
SKU	Size	Availability	Price
D155384-200mg	200mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$34.90
D155384-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$133.90
D155384-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$399.90

View related series

Carbonyl compound (2335) ureas (94)

Basic Description

Synonyms	N,N'-Diallylurea \| Urea,3-diallyl- \| DIALLYL UREA \| 1,3-Diallylurea \| AS-59431 \| D5170 \| DTXSID80170917 \| LXM0XY469I \| Urea,N'-di-2-propenyl- \| 5-Amino-1-beta-D-ribofuranosyl-1H-imidazole-4-carboxamide \| 1,3-Diallylurea, 98% \| Morton EP-316 \| Urea, 1,3-di
Specifications & Purity	≥98%(GC)
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

IUPAC Name	1,3-bis(prop-2-enyl)urea
INCHI	InChI=1S/C7H12N2O/c1-3-5-8-7(10)9-6-4-2/h3-4H,1-2,5-6H2,(H2,8,9,10)
InChIKey	QRWVOJLTHSRPOA-UHFFFAOYSA-N
Smiles	C=CCNC(=O)NCC=C
Isomeric SMILES	C=CCNC(=O)NCC=C
Molecular Weight	140.19
Reaxy-Rn	1754798
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1754798&ln=

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

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

Analytical Chart:

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Lot Number	Certificate Type	Date	Item
K2420493	Certificate of Analysis	Apr 16, 2024	D155384

Chemical and Physical Properties

Solubility	Soluble in Methanol
Boil Point(°C)	56°C/10mmHg(lit.)
Melt Point(°C)	98℃
Molecular Weight	140.180 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	140.095 Da
Monoisotopic Mass	140.095 Da
Topological Polar Surface Area	41.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	118.000
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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