Methyl 6-Aminopyridazine-3-carboxylate - CAS 98140-96-6

Catalog:	BB042118
Product Name:	Methyl 6-Aminopyridazine-3-carboxylate
CAS:	98140-96-6
Synonyms:	6-amino-3-pyridazinecarboxylic acid methyl ester; methyl 6-aminopyridazine-3-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 6-aminopyridazine-3-carboxylate
Description:	Methyl 6-Aminopyridazine-3-carboxylate (CAS# 98140-96-6) is a useful research chemical.
Molecular Weight:	153.14
Molecular Formula:	C6H7N3O2
Canonical SMILES:	COC(=O)C1=NN=C(C=C1)N
InChI:	InChI=1S/C6H7N3O2/c1-11-6(10)4-2-3-5(7)9-8-4/h2-3H,1H3,(H2,7,9)
InChI Key:	UVTBEJGKSJOOIF-UHFFFAOYSA-N
Boiling Point:	422.1 °C at 760 mmHg
Density:	1.319 g/cm³
Storage:	Keep in dark place, Sealed in dry, 2-8 °C
LogP:	0.42660

Publication Number	Title	Priority Date
CN-112979655-A	Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof	20191216
WO-2021121294-A1	Triazolopyridazine derivative, preparation method therefor, pharmaceutical composition thereof, and use thereof	20191216
WO-2021058017-A1	Degradation of androgen receptor (ar) by conjugation of ar antagonists with e3 ligase ligand and methods of use	20190929
AU-2018260686-A1	Novel GLP-1 receptor modulators	20170428
CA-3060424-A1	Novel glp-1 receptor modulators	20170428

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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:	151
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.053826475
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.053826475
Rotatable Bond Count:	2
Topological Polar Surface Area:	78.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8