6-Methylpyridazine-3-carboxylic Acid - CAS 64210-60-2

Catalog:	BB032404
Product Name:	6-Methylpyridazine-3-carboxylic Acid
CAS:	64210-60-2
Synonyms:	6-methyl-3-pyridazinecarboxylic acid; 6-methylpyridazine-3-carboxylic acid

Technical Data

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Patents

Computed Properties

IUPAC Name:	6-methylpyridazine-3-carboxylic acid
Description:	6-Methylpyridazine-3-carboxylic Acid (CAS# 64210-60-2) is a useful research chemical.
Molecular Weight:	138.12
Molecular Formula:	C6H6N2O2
Canonical SMILES:	CC1=NN=C(C=C1)C(=O)O
InChI:	InChI=1S/C6H6N2O2/c1-4-2-3-5(6(9)10)8-7-4/h2-3H,1H3,(H,9,10)
InChI Key:	SJWGLCDFBFCHNV-UHFFFAOYSA-N
Boiling Point:	407.91 °C at 760 mmHg
Density:	1.319 g/cm³
Appearance:	White to brown solid
LogP:	0.48320

Publication Number	Title	Priority Date
WO-2021032687-A1	Antimalarial hexahydropyrimidine analogues	20190819
WO-2020198026-A1	Compounds and uses thereof	20190322
WO-2020072835-A1	11,13-modified saxitoxins for the treatment of pain	20181003
EP-3860714-A1	11,13-modified saxitoxins for the treatment of pain	20181003
WO-2019183587-A1	Compounds and uses thereof	20180323

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride

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:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.042927438
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	138.042927438
Rotatable Bond Count:	1
Topological Polar Surface Area:	63.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1