5-Chloropyrazine-2-methanamine - CAS 1060814-53-0

Catalog:	BB001798
Product Name:	5-Chloropyrazine-2-methanamine
CAS:	1060814-53-0
Synonyms:	(5-chloro-2-pyrazinyl)methanamine; (5-chloropyrazin-2-yl)methanamine

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Computed Properties

IUPAC Name:	(5-chloropyrazin-2-yl)methanamine
Description:	5-Chloropyrazine-2-methanamine (CAS# 1060814-53-0) is a reagent used for the preparation of alkyl and aryl azides by chemoselective diazotization of primary amines with in situ-generated fluorosulfonyl azide.
Molecular Weight:	143.57
Molecular Formula:	C5H6ClN3
Canonical SMILES:	C1=C(N=CC(=N1)Cl)CN
InChI:	InChI=1S/C5H6ClN3/c6-5-3-8-4(1-7)2-9-5/h2-3H,1,7H2
InChI Key:	SYZWYECIPSWFJM-UHFFFAOYSA-N
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	1.28900

Publication Number	Title	Priority Date
WO-2021122415-A1	Furoindazole derivatives	20191219
WO-2021126923-A1	Cd206 modulators their use and methods for preparation	20191219
US-10323036-B2	TYK2 inhibitors and uses thereof	20161014
US-2018155349-A1	Tyk2 inhibitors and uses thereof	20161014
US-2019284194-A1	Tyk2 inhibitors and uses thereof	20161014

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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, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	88.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.0250249
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	143.0250249
Rotatable Bond Count:	1
Topological Polar Surface Area:	51.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4