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39900-81-7

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Basic Information
CAS No.: 39900-81-7
Name: 1-(5-CHLORO-2-METHOXY-PHENYL)-PYRROLE-2,5-DIONE
Molecular Structure:
Molecular Structure of 39900-81-7 (1-(5-CHLORO-2-METHOXY-PHENYL)-PYRROLE-2,5-DIONE)
Formula: C11H8ClNO3
Molecular Weight: 237.642
Synonyms: Maleimide,N-(5-chloro-2-methoxyphenyl)- (7CI);
Density: 1.429 g/cm3
Boiling Point: 390 °C at 760 mmHg
Flash Point: 189.6 °C
PSA: 46.61000
LogP: 1.84300
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Specification

The CAS register number of 1H-Pyrrole-2,5-dione,1-(5-chloro-2-methoxyphenyl)- is 39900-81-7. It also can be called as 1-(5-chloro-2-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione and the IUPAC name about this chemical is 1-(5-chloro-2-methoxyphenyl)pyrrole-2,5-dione. The molecular formula about this chemical is C11H8ClNO3 and the molecular weight is 237.6391.

Physical properties about 1H-Pyrrole-2,5-dione,1-(5-chloro-2-methoxyphenyl)- are: (1)ACD/LogP: 1.69; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 46.61Å2; (5)Index of Refraction: 1.613; (6)Molar Refractivity: 57.89 cm3; (7)Molar Volume: 166.2 cm3; (8)Polarizability: 22.95x10-24cm3; (9)Surface Tension: 55.8 dyne/cm; (10)Flash Point: 189.6 °C; (11)Enthalpy of Vaporization: 63.94 kJ/mol; (12)Boiling Point: 390 °C at 760 mmHg; (13)Vapour Pressure: 2.75E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(OC)c(c1)N2C(=O)\C=C/C2=O
(2)InChI: InChI=1/C11H8ClNO3/c1-16-9-3-2-7(12)6-8(9)13-10(14)4-5-11(13)15/h2-6H,1H3
(3)InChIKey: KRYUCWYKHXDVIC-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C11H8ClNO3/c1-16-9-3-2-7(12)6-8(9)13-10(14)4-5-11(13)15/h2-6H,1H3
(5)Std. InChIKey: KRYUCWYKHXDVIC-UHFFFAOYSA-N