Ethyl 5-Bromo-1H-indazole-3-carboxylate - CAS 1081-04-5

Catalog:	BB002170
Product Name:	Ethyl 5-Bromo-1H-indazole-3-carboxylate
CAS:	1081-04-5
Synonyms:	5-bromo-1H-indazole-3-carboxylic acid ethyl ester; ethyl 5-bromo-1H-indazole-3-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 5-bromo-1H-indazole-3-carboxylate
Description:	Ethyl 5-Bromo-1H-indazole-3-carboxylate (CAS# 1081-04-5) is a useful research chemical.
Molecular Weight:	269.09
Molecular Formula:	C10H9BrN2O2
Canonical SMILES:	CCOC(=O)C1=NNC2=C1C=C(C=C2)Br
InChI:	InChI=1S/C10H9BrN2O2/c1-2-15-10(14)9-7-5-6(11)3-4-8(7)12-13-9/h3-5H,2H2,1H3,(H,12,13)
InChI Key:	DKVWLGFTRAWGAD-UHFFFAOYSA-N
Boiling Point:	406.4 °C at 760 mmHg
Density:	1.624 g/cm³
LogP:	2.50210

Publication Number	Title	Priority Date
AU-2017345699-A1	Methods of using indazole-3-carboxamides and their use as Wnt/B-catenin signaling pathway inhibitors	20161021
BR-112019008061-A2	methods of using indazol-3-carboxamides and their use as inhibitors of the wnt / b-catenin signaling pathway	20161021
CA-3041291-A1	Methods of using indazole-3-carboxamides and their use as wnt/b-catenin signaling pathway inhibitors	20161021
CN-110709082-A	Methods of use of indazole-3-carboxamides and their use as inhibitors of the Wnt/beta-catenin signaling pathway	20161021
EP-3528808-A1	Methods of using indazole-3-carboxamides and their use as wnt/b-catenin signaling pathway inhibitors	20161021

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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
[87-88-7]
Chloranilic acid
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[55441-25-3]
1-(2-Cyanophenyl)urea
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic 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+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	267.98474
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	267.98474
Rotatable Bond Count:	3
Topological Polar Surface Area:	55 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8