Methyl 6-Bromo-1H-indazole-3-carboxylate - CAS 885278-42-2

Catalog:	BB038946
Product Name:	Methyl 6-Bromo-1H-indazole-3-carboxylate
CAS:	885278-42-2
Synonyms:	6-bromo-1H-indazole-3-carboxylic acid methyl ester; methyl 6-bromo-1H-indazole-3-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 6-bromo-1H-indazole-3-carboxylate
Description:	Methyl 6-Bromo-1H-indazole-3-carboxylate (CAS# 885278-42-2) is a useful research chemical.
Molecular Weight:	255.07
Molecular Formula:	C9H7BrN2O2
Canonical SMILES:	COC(=O)C1=NNC2=C1C=CC(=C2)Br
InChI:	InChI=1S/C9H7BrN2O2/c1-14-9(13)8-6-3-2-5(10)4-7(6)11-12-8/h2-4H,1H3,(H,11,12)
InChI Key:	FIPMZRPZSZXFGK-UHFFFAOYSA-N
Boiling Point:	399.674 °C at 760 mmHg
Density:	1.71 g/cm³
Appearance:	Pale-yellow to yellow-brown solid
LogP:	2.11200

Publication Number	Title	Priority Date
WO-2021067654-A1	Indazole carboxamides as kinase inhibitors	20191003
WO-2020056072-A1	1h-indazole carboxamides as receptor-interacting protein kinase 1 inhibitors (ripk1)	20180913
WO-2020056074-A1	Indazole carboxamides as kinase inhibitors	20180913
CN-112673000-A	1H-indazole carboxamides as receptor interacting protein kinase 1 inhibitors (RIPK1)	20180913
CN-112673001-A	Indazole carboxamides as kinase inhibitors	20180913

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[55441-25-3]
1-(2-Cyanophenyl)urea
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	237
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	253.96909
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	253.96909
Rotatable Bond Count:	2
Topological Polar Surface Area:	55 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4