Poly[1,1-bis(chloromethyl)trimethylene oxide]

Poly[1,1-bis(chloromethyl)trimethylene oxide]

Poly[1,1-bis(chloromethyl)trimethylene oxide]

NAMES AND IDENTIFIERS OF POLYMER

POLYMER CLASS	Polyglycol
COMMON NAMES	Poly[1,1-bis(chloromethyl)trimethylene oxide]
STRUCTURE BASED NAME	Poly[oxy-1,1-bis(chloromethyl)trimethylene)]
ACRONYMS
CAS #
CurlySMILES	C{-}(CCl)(CCl)CCO{n+}

IDENTIFIERS OF MONOMER(S)

CAS #	201-136-5
COMMON NAMES	3,3-Bis(chloromethyl)oxetane, 3,3-Bis(chloromethyl)oxetane
SMILES	C1C(CO1)(CCl)CCl
Std. InChI	InChI=1S/C5H8Cl2O/c6-3-5(4-7)1-2-8-5/h1-4H2
Std. InChIKey	CXURGFRDGROIKG-UHFFFAOYSA-N
STRUCTURE

Thermo-Physical Properties: Experimental / Literature Data

PROPERTY	UNIT	VALUE / RANGE	PREFERRED
Molar Volume V_m	mL mol^-1	111.5
Density ρ	g mL^-1	1.39
Solubility Parameter δ	MPa^1/2
Molar Cohesive Energy E_coh	J mol^-1
Glass Transition Temperature T_g	K	265 - 278	272
Molar Heat Capacity C_p	J (mol K)^-1	177
Entanglement Molecular Weight M_e	g mol^-1
Index of Refraction n	none

Thermo-Physical Properties: Calculated Data

PROPERTY	UNIT	VALUE / RANGE	PREFERRED
Molecular Weight of Repeat unit	g mol^-1	155.02
Van-der-Waals Volume V_vW	mL mol^-1	69.9
Molar Volume V_m	mL mol^-1	110.5 - 116.5	113
Density ρ	g mL^-1	1.33 - 1.40	1.37
Solubility Parameter δ	MPa^1/2	19.0 - 20.3	19.8
Molar Cohesive Energy E_coh	J mol^-1	42000 - 45500	44000
Glass Transition Temperature T_g	K	252 - 315	283
Molar Heat Capacity C_p	J (mol K)^-1	175 - 179	177
Entanglement Molecular Weight M_e	g mol^-1
Index of Refraction n	none	1.52 - 1.54	1.54

Last updated: August 5, 2016

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