Poly[4- (diacetoxyiodo) styrene]

CAT: 0024-sc-296123ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-296123ASize:5 g

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CAS Number

36290-94-5

Chemical Information

[Acetyloxy-(4-ethenylphenyl)-lambda3-iodanyl] acetate;azane

CAS Number	36290-94-5
PubChem CID	179000737
IUPAC Name	[acetyloxy-(4-ethenylphenyl)-lambda3-iodanyl] acetate;azane
Molecular Formula	C12H16INO4
Molecular Weight	365.16
Topological Polar Surface Area	53.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	18
Formal Charge	0
Complexity	279

SMILES

CC(=O)OI(C1=CC=C(C=C1)C=C)OC(=O)C.N

InChI

InChI=1S/C12H13IO4.H3N/c1-4-11-5-7-12(8-6-11)13(16-9(2)14)17-10(3)15;/h4-8H,1H2,2-3H3;1H3

InChIKey

GFGTWSIVNCQXQL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 36290-94-5

CID: 179000737

Formula: C12H16INO4

MW: 365.16

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	365.16
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	365.01241
Monoisotopic Mass	365.01241
Topological Polar Surface Area	53.6 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	279
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
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