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143541-91-7

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Basic Information
CAS No.: 143541-91-7
Name: 1-(2-Cyclopenten-1-yl)-2,4(1h,3h)-pyrimidinedione
Article Data: 3
Molecular Structure:
Molecular Structure of 143541-91-7 (1-(2-Cyclopenten-1-yl)-2,4(1h,3h)-pyrimidinedione)
Formula: C9H10N2O2
Molecular Weight: 178.07
Synonyms: 1-(2-CYCLOPENTEN-1-YL)-2,4(1H,3H)-PYRIMIDINEDIONE
Density: 1.334 g/cm3
PSA: 55.12000
LogP: 0.84000
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    1-(2-CYCLOPENTEN-1-YL)- 2,4(1H,3H)-PYRIMIDINEDIONECASAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Specification

The CAS register number of 1-(2-Cyclopenten-1-yl)-2,4(1h,3h)-pyrimidinedione is 143541-91-7. The systematic name about this chemical is 1-cyclopent-1-en-1-ylpyrimidine-2,4(1H,3H)-dione. The molecular formula about this chemical is C9H10N2O2 and the molecular weight is 178.07.

Physical properties about 1-(2-Cyclopenten-1-yl)-2,4(1h,3h)-pyrimidinedione are: (1)ACD/LogP: 0.53; (2)ACD/LogD (pH 5.5): 0.53; (3)ACD/LogD (pH 7.4): 0.52; (4)ACD/BCF (pH 5.5): 1.5; (5)ACD/BCF (pH 7.4): 1.45; (6)ACD/KOC (pH 5.5): 46.43; (7)ACD/KOC (pH 7.4): 44.94; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 49.41 Å2; (12)Index of Refraction: 1.604; (13)Molar Refractivity: 45.92 cm3; (14)Molar Volume: 133.4 cm3; (15)Polarizability: 18.2x10-24cm3; (16)Surface Tension: 57.6 dyne/cm; (17)Density: 1.334 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2NC(=O)/C=C\N2C\1=C\CCC/1
(2)InChI: InChI=1/C9H10N2O2/c12-8-5-6-11(9(13)10-8)7-3-1-2-4-7/h3,5-6H,1-2,4H2,(H,10,12,13)
(3)InChIKey: KVLORIHXDWELDS-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C9H10N2O2/c12-8-5-6-11(9(13)10-8)7-3-1-2-4-7/h3,5-6H,1-2,4H2,(H,10,12,13)
(5)Std. InChIKey: KVLORIHXDWELDS-UHFFFAOYSA-N