4-Bromo-1H-indazol-3(2H)-one - CAS 864845-15-8

Catalog:	BB037957
Product Name:	4-Bromo-1H-indazol-3(2H)-one
CAS:	864845-15-8
Synonyms:	4-bromo-1,2-dihydroindazol-3-one; 4-bromo-1,2-dihydroindazol-3-one

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-1,2-dihydroindazol-3-one
Description:	4-Bromo-1H-indazol-3(2H)-one (CAS# 864845-15-8) is a useful research chemical.
Molecular Weight:	213.03
Molecular Formula:	C7H5BrN2O
Canonical SMILES:	C1=CC2=C(C(=C1)Br)C(=O)NN2
InChI:	InChI=1S/C7H5BrN2O/c8-4-2-1-3-5-6(4)7(11)10-9-5/h1-3H,(H2,9,10,11)
InChI Key:	AOSWBTIWUXRHRT-UHFFFAOYSA-N
LogP:	2.03100

Publication Number	Title	Priority Date
AU-2006319231-A1	3-amino-1-arylpropyl indoles and aza-substituted indoles	20051130
BR-PI0619263-A2	3-amino-1-arylpropyl indoles and aza-substituted indoles, methods for preparing them, pharmaceutical composition and use of said indoles	20051130
CA-2629962-A1	3-amino-1-arylpropyl indoles and aza-substituted indoles	20051130
EP-1960355-A1	3-amino-1-arylpropyl indoles and aza-substituted indoles	20051130
EP-2351737-A1	3-Amino-1-arylpropyl indoles and aza-substituted indoles	20051130

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Related Functional Groups

Indazoles

[1341035-91-3]
Ethyl 3-iodo-4,5,6,7-tetrahydro-1H-indazole-5-carboxylate
[253801-04-6]
Indazole-5-carboxaldehyde
[1006-28-6]
(1H-Indazol-3-yl)-methyl-amine
[290368-00-2]
1-Boc-3-iodo-1H-indazole
[1956318-62-9]
3-Amino-5-[(3,5-difluorophenyl)difluoromethyl]-1H-indazole
[885518-50-3]
4-Amino-6-bromo-1H-indazole

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Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.95853
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	211.95853
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8