2-Iodo-4-nitrophenol

CAT: 0024-sc-230421Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-230421Size:1 g

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CAS Number

89487-91-2

Chemical Information

2-Iodo-4-nitrophenol

CAS Number	89487-91-2
PubChem CID	284949
IUPAC Name	2-iodo-4-nitrophenol
Molecular Formula	C6H4INO3
Molecular Weight	265.01
XLogP	2
Topological Polar Surface Area	66.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	158

SMILES

C1=CC(=C(C=C1[N+](=O)[O-])I)O

InChI

InChI=1S/C6H4INO3/c7-5-3-4(8(10)11)1-2-6(5)9/h1-3,9H

InChIKey

BKQFOYCEUMVWOW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 89487-91-2

CID: 284949

Formula: C6H4INO3

MW: 265.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	265.01
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	264.92359
Monoisotopic Mass	264.92359
Topological Polar Surface Area	66.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	158
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	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-473551	3-Iodo-4-nitrophenol
sc-280278	2-Iodo-4-methyl-6-nitrophenol
sc-482603	3-Iodo-2-nitrophenol
sc-491205	2- ((2-Hydroxy-4-nitrophenyl) diazenyl) -4-nitrophenol
sc-287852	2-Bromo-4-nitrophenol
sc-341465A	2-benzyl-4-nitrophenol
sc-230307	2-Fluoro-4-nitrophenol
sc-232552	4-Chloro-2-nitrophenol
sc-274164	2-allyl-4-nitrophenol
sc-225473	2-Methyl-4-nitrophenol