1-(1H-Indazol-5-yl)ethanamine - CAS 1001906-62-2

Catalog:	BB000122
Product Name:	1-(1H-Indazol-5-yl)ethanamine
CAS:	1001906-62-2
Synonyms:	1-(1H-indazol-5-yl)ethanamine; 1-(1H-indazol-5-yl)ethanamine

Technical Data

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Computed Properties

IUPAC Name:	1-(1H-indazol-5-yl)ethanamine
Description:	1-(1H-Indazol-5-yl)ethanamine (CAS# 1001906-62-2) is a useful research chemical.
Molecular Weight:	161.20
Molecular Formula:	C9H11N3
Canonical SMILES:	CC(C1=CC2=C(C=C1)NN=C2)N
InChI:	InChI=1S/C9H11N3/c1-6(10)7-2-3-9-8(4-7)5-11-12-9/h2-6H,10H2,1H3,(H,11,12)
InChI Key:	XAOQGHCTRDZPSK-UHFFFAOYSA-N
LogP:	2.28290

Publication Number	Title	Priority Date
WO-2020182990-A1	Fused ring pyrimidone derivatives for use in the treatment of hbv infection or of hbv-induced diseases	20190314
WO-2012052745-A1	Combinations of pi3k inhibitors with a second anti -tumor agent	20101021
WO-2010119264-A1	Imidazopyrazines for use as kinase inhibitors	20090416
EP-2240467-A1	Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same	20080109
EP-2240467-B1	Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same	20080109

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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:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.095297364
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	161.095297364
Rotatable Bond Count:	1
Topological Polar Surface Area:	54.7 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1