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712-43-6

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Basic Information
CAS No.: 712-43-6
Name: 1-CYCLOHEXYLURACIL
Article Data: 2
Molecular Structure:
Molecular Structure of 712-43-6 (1-CYCLOHEXYLURACIL)
Formula: C10H14N2O2
Molecular Weight: 194.233
Synonyms: Uracil,1-cyclohexyl- (7CI,8CI);1-Cyclohexylbarbituric acid;1-Cyclohexyluracil;N1-Cyclohexyluracil;NSC 76947;
Density: 1.214 g/cm3
Risk Codes: 20/21/22
Safety: 3/7-36/37
PSA: 54.86000
LogP: 1.04180
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Specification

The 2,4(1H,3H)-Pyrimidinedione,1-cyclohexyl-, also known as 1-Cyclohexyluracil, is an organic compound with the formula C10H14N2O2. With the CAS registry number 712-43-6, its IUPAC name is 1-cyclohexylpyrimidine-2,4-dione.

Physical properties of 2,4(1H,3H)-Pyrimidinedione,1-cyclohexyl-: (1)ACD/LogP: 0.86; (2)ACD/LogD (pH 5.5): 0.86; (3)ACD/LogD (pH 7.4): 0.85; (4)ACD/BCF (pH 5.5): 2.66; (5)ACD/BCF (pH 7.4): 2.61; (6)ACD/KOC (pH 5.5): 70.15; (7)ACD/KOC (pH 7.4): 68.78; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.549; (12)Molar Refractivity: 50.94 cm3; (13)Molar Volume: 159.9 cm3; (14)Surface Tension: 48.4 dyne/cm; (15)Density: 1.214 g/cm3.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC(CC1)N2C=CC(=O)NC2=O
(2)InChI: InChI=1S/C10H14N2O2/c13-9-6-7-12(10(14)11-9)8-4-2-1-3-5-8/h6-8H,1-5H2,(H,11,13,14)
(3)InChIKey: SYRKUUKGYSRJPB-UHFFFAOYSA-N