6-chloro-4-methoxypyridazin-3-amine - CAS 808770-39-0

Catalog:	BB036576
Product Name:	6-chloro-4-methoxypyridazin-3-amine
CAS:	808770-39-0
Synonyms:	6-chloro-4-methoxy-3-pyridazinamine; 6-chloro-4-methoxypyridazin-3-amine

Technical Data

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Computed Properties

IUPAC Name:	6-chloro-4-methoxypyridazin-3-amine
Description:	6-chloro-4-methoxypyridazin-3-amine (CAS# 808770-39-0) is a useful research chemical.
Molecular Weight:	159.573
Molecular Formula:	C5H6ClN3O
Canonical SMILES:	COC1=CC(=NN=C1N)Cl
InChI:	InChI=1S/C5H6ClN3O/c1-10-3-2-4(6)8-9-5(3)7/h2H,1H3,(H2,7,9)
InChI Key:	KCKFEBMJVVTSKC-UHFFFAOYSA-N
LogP:	0.65090

Publication Number	Title	Priority Date
WO-2021086785-A1	Bifunctional compounds	20191028
US-2020181153-A1	Imidazopyridazinone compounds and uses thereof	20181210
WO-2020123422-A1	Imidazopyridazinone compounds and uses thereof	20181210
US-2021269454-A1	Cycloalkane-1,3-diamine derivative	20181206
AU-2018355743-A1	Pyridine carbonyl derivatives and therapeutic uses thereof as TRPC6 inhibitors	20171027

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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:	113
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	159.0199395
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	159.0199395
Rotatable Bond Count:	1
Topological Polar Surface Area:	61 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4