Poly[di(n-hexyl) itaconate]
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Poly[di(n-propyl) itaconate]
 

NAMES AND IDENTIFIERS OF POLYMER

POLYMER CLASS Polyitaconate
COMMON NAMESPoly[di(n-hexyl) itaconate]
STRUCTURE BASED NAME Poly[di(n-hexyl)-2-methylidene butandioate], Poly[di(n-hexyl)-2-methylenesuccinate]
ACRONYMS
CAS #
CurlySMILES C{-}(C(=O)OCCCCCC)(CC(=O)OCCCCCC)C{n+}
 

IDENTIFIERS OF MONOMER(S)

CAS # 13401-98-4
COMMON NAMESDi(n-hexyl) itaconate, Dihexyl 2-methylenesuccinate
SMILES CCCCCCOC(=O)CC(=C)C(=O)OCCCCCC
Std. InChI 1S/C17H30O4/c1-4-6-8-10-12-20-16(18)14-15(3)17(19)21-13-11-9-7-5-2/h3-14H2,1-2H3
Std. InChIKey MHAOABLQRSMPKK-UHFFFAOYSA-N
STRUCTURE
Dihexyl-2-methylenesuccinate
 

Thermo-Physical Properties: Experimental / Literature Data

PROPERTYUNITVALUE / RANGEPREFERRED
Molar Volume VmmL mol-1
Density ρg mL-1
Solubility Parameter δMPa1/2 17 - 1817.5
Molar Cohesive Energy EcohJ mol-1 84000 - 9300087000
Glass Transition Temperature TgK 248 - 255255 (2631)
Molar Heat Capacity CpJ (mol K)-1 486 (s)1
Entanglement Molecular Weight Meg mol-1
Index of Refraction nnone
 

Thermo-Physical Properties: Calculated Data

PROPERTYUNITVALUE / RANGEPREFERRED
Molecular Weight of Repeat unitg mol-1 298.4
Van-der-Waals Volume VvWmL mol-1 184.4
Molar Volume VmmL mol-1 281 - 288284
Density ρ g mL-1 1.04 - 1.061.05
Solubility Parameter δMPa1/2 17.8 - 18.718.2
Molar Cohesive Energy EcohJ mol-1 84000 - 9300086500
Glass Transition Temperature TgK 240 -287269
Molar Heat Capacity CpJ (mol K)-1 464 - 491.5
564.5 - 593
475 (s)
579.5 (l,r)
Entanglement Molecular Weight Meg mol-1   
Index of Refraction nnone   
1Extrapolated from experimental data
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