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Urea,N,N'-di-2-propen-1-yl-

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Name

Urea,N,N'-di-2-propen-1-yl-

EINECS 217-291-7
CAS No. 1801-72-5 Density 0.94 g/cm3
PSA 41.13000 LogP 1.43940
Solubility N/A Melting Point 90-93 °C(lit.)
Formula C7H12N2O Boiling Point 285.3 °C at 760 mmHg
Molecular Weight 140.185 Flash Point 129.6 °C
Transport Information N/A Appearance white to light yellow crystals.
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1801-72-5 (1,3-DIALLYLUREA) Hazard Symbols N/A
Synonyms

Urea,1,3-diallyl- (6CI,7CI,8CI);Urea, N,N'-di-2-propenyl- (9CI);1,3-Diallylurea;N,N'-Bis(2-propenyl)urea;N,N'-Di-2-propenylurea;N,N'-Diallylurea;NSC 102722;

Article Data 30

Urea,N,N'-di-2-propen-1-yl- Specification

The Urea,N,N'-di-2-propen-1-yl- is an organic compound with the formula C7H12N2O. The IUPAC name of this chemical is 1,3-bis(prop-2-enyl)urea. With the CAS registry number 1801-72-5, it is also named as Urea, N,N'-di-2-propenyl-. The product's categories are Carbonyl Compounds; Organic Building Blocks; Ureas. Besides, it should be stored in a closed cool and dry place.

Physical properties about Urea,N,N'-di-2-propen-1-yl- are: (1)ACD/LogP: 0.72; (2)ACD/LogD (pH 5.5): 0.72; (3)ACD/LogD (pH 7.4): 0.72; (4)ACD/BCF (pH 5.5): 2.09; (5)ACD/BCF (pH 7.4): 2.09; (6)ACD/KOC (pH 5.5): 58.93; (7)ACD/KOC (pH 7.4): 58.93; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 23.55 Å2; (12)Index of Refraction: 1.464; (13)Molar Refractivity: 41.14 cm3; (14)Molar Volume: 149 cm3; (15)Polarizability: 16.31×10-24cm3; (16)Surface Tension: 30.3 dyne/cm; (17)Density: 0.94 g/cm3; (18)Flash Point: 129.6 °C; (19)Enthalpy of Vaporization: 52.44 kJ/mol; (20)Boiling Point: 285.3 °C at 760 mmHg; (21)Vapour Pressure: 0.00282 mmHg at 25°C.

Preparation of Urea,N,N'-di-2-propen-1-yl-: this chemical can be prepared by allylamine and carbon dioxide. This reaction will need catalysts Ph3SbO, P4S10 and solvent benzene. The reaction time is 12 hours with reaction temperature of 80 °C. The yield is about 62%.

Urea,N,N'-di-2-propen-1-yl- can be prepared by allylamine and carbon dioxide

Uses of Urea,N,N'-di-2-propen-1-yl-: it can be used to produce 1,3-diallyl-3α,8α-dihydroxy-1,3,3α,8α-tetrahydro-indeno[1,2-d]imidazole-2,8-dione at temperature of 50 - 60 °C. It will need reagent solvent H2O. The yield is about 56%.

Urea,N,N'-di-2-propen-1-yl- and indan-1,2,3-trione hydrate can be used to produce 1,3-diallyl-3α,8α-dihydroxy-1,3,3α,8α-tetrahydro-indeno[1,2-d]imidazole-2,8-dione

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NC/C=C)NC\C=C
(2)InChI: InChI=1/C7H12N2O/c1-3-5-8-7(10)9-6-4-2/h3-4H,1-2,5-6H2,(H2,8,9,10)
(3)InChIKey: QRWVOJLTHSRPOA-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H12N2O/c1-3-5-8-7(10)9-6-4-2/h3-4H,1-2,5-6H2,(H2,8,9,10)
(5)Std. InChIKey: QRWVOJLTHSRPOA-UHFFFAOYSA-N

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