4-((4-(Allyloxy)phenyl)sulfonyl)phenol - CAS 97042-18-7

Catalog:	BB061259
Product Name:	4-((4-(Allyloxy)phenyl)sulfonyl)phenol
CAS:	97042-18-7
Synonyms:	4-[[4-(2-propenyloxy)phenyl]sulfonyl]phenol; 4-Allyloxy-4'-hydroxydiphenylsulfone; 4-Hydroxy-4'-allyloxy Diphenyl Sulfone; 4'-Allyloxyphenylsulfonyl-4-phenol; BIS-MAE; BPS-MAE; Bis(4-hydroxyphenyl)sulfone Monoallyl Ether

Technical Data

IUPAC Name:	4-(4-prop-2-enoxyphenyl)sulfonylphenol
Description:	4-((4-(Allyloxy)phenyl)sulfonyl)phenol is an additive to enhance the flame-retardation of unsaturated polyester resin (FR-UPR).
Molecular Weight:	290.33
Molecular Formula:	C15H14O4S
Canonical SMILES:	C=CCOC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)O
InChI:	InChI=1S/C15H14O4S/c1-2-11-19-13-5-9-15(10-6-13)20(17,18)14-7-3-12(16)4-8-14/h2-10,16H,1,11H2
InChI Key:	FKZIDBGIZLBDDF-UHFFFAOYSA-N
Melting Point:	168 - 170°C
Solubility:	Chloroform (Slightly, Heated), DMSO (Slightly), Methanol (Slightly)
Appearance:	White to Off-White Solid
Storage:	-20°C, Inert atmosphere, Light sensitive
References:	Dai, K., et. al. Ind. Eng. Chem. Res., 51, 15918 (2012).

Complexity:	396
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	290.0612801
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	290.0612801
Rotatable Bond Count:	5
Topological Polar Surface Area:	72Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9