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3-Amino-5-iodo-1H-indazole

3-Amino-5-iodo-1H-indazole - CAS 88805-76-9

Catalog:	BB039260
Product Name:	3-Amino-5-iodo-1H-indazole
CAS:	88805-76-9
Synonyms:	5-iodo-1H-indazol-3-amine; 5-iodo-1H-indazol-3-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-iodo-1H-indazol-3-amine
Description:	3-Amino-5-iodo-1H-indazole (CAS# 88805-76-9) is a useful research chemical.
Molecular Weight:	259.05
Molecular Formula:	C7H6IN3
Canonical SMILES:	C1=CC2=C(C=C1I)C(=NN2)N
InChI:	InChI=1S/C7H6IN3/c8-4-1-2-6-5(3-4)7(9)11-10-6/h1-3H,(H3,9,10,11)
InChI Key:	GBUVSJWTWOWRSL-UHFFFAOYSA-N
MDL:	MFCD09261138
LogP:	2.33090

Publication Number	Title	Priority Date
EP-3165523-A2	Composition for inducing cell reprogramming	20140701
WO-2015110467-A1	Process for the preparation of substituted n-(5-benzenesulfonyl-1h-indazol-3-yl)-benzamides	20140123
AU-2014345771-A1	(aza)pyridopyrazolopyrimidinones and indazolopyrimidinones as inhibitors of fibrinolysis	20131105
CA-2929378-A1	(aza)pyridopyrazolopyrimidinones and indazolopyrimidinones and their use	20131105
CN-105683194-A	(aza)pyridopyrazolopyrimidinones and indazolopyrimidinones as inhibitors of fibrinolysis	20131105

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Related Functional Groups

Halides

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	258.96064
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	258.96064
Rotatable Bond Count:	0
Topological Polar Surface Area:	54.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9