4-Amino-3,5-diiodopyridine - CAS 98136-86-8

Catalog:	BB042115
Product Name:	4-Amino-3,5-diiodopyridine
CAS:	98136-86-8
Synonyms:	3,5-diiodo-4-pyridinamine; 3,5-diiodopyridin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	3,5-diiodopyridin-4-amine
Description:	4-Amino-3,5-diiodopyridine (CAS# 98136-86-8) is a useful research chemical.
Molecular Weight:	345.91
Molecular Formula:	C5H4I2N2
Canonical SMILES:	C1=C(C(=C(C=N1)I)N)I
InChI:	InChI=1S/C5H4I2N2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChI Key:	XDDQGODHCQZZEH-UHFFFAOYSA-N
Boiling Point:	408.1 °C at 760 mmHg
Density:	2.679 g/cm³
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	2.45420

Publication Number	Title	Priority Date
CN-104262242-A	method for synthesizing 3,5-diiodo-4-aminopyridine by employing in-situ iodized reagent production method	20140922
CN-104262242-B	The in-situ preparation iodo reagent method synthesis iodo-4-aminopyridine of 3,5-bis-	20140922
US-2006106020-A1	Tetracyclic inhibitors of Janus kinases	20040428
US-2009215766-A1	Tetracyclic inhibitors of janus kinases	20040428
WO-2005105814-A1	Tetracyclic inhibitors of janus kinases	20040428

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	89
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	345.84639
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	345.84639
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5