Ethyl 2-Bromobenzothiazole-6-carboxylate - CAS 99073-88-8

Catalog:	BB042255
Product Name:	Ethyl 2-Bromobenzothiazole-6-carboxylate
CAS:	99073-88-8
Synonyms:	2-bromo-1,3-benzothiazole-6-carboxylic acid ethyl ester; ethyl 2-bromo-1,3-benzothiazole-6-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 2-bromo-1,3-benzothiazole-6-carboxylate
Description:	Ethyl 2-Bromobenzothiazole-6-carboxylate (CAS# 99073-88-8) is a useful research chemical.
Molecular Weight:	286.15
Molecular Formula:	C10H8BrNO2S
Canonical SMILES:	CCOC(=O)C1=CC2=C(C=C1)N=C(S2)Br
InChI:	InChI=1S/C10H8BrNO2S/c1-2-14-9(13)6-3-4-7-8(5-6)15-10(11)12-7/h3-5H,2H2,1H3
InChI Key:	JQZQKEZCRZNJPC-UHFFFAOYSA-N
Boiling Point:	377.583 °C at 760 mmHg
Density:	1.618 g/cm³
MDL:	MFCD08669850
LogP:	3.23550

Publication Number	Title	Priority Date
WO-2021014855-A1	Compound, composition, film, laminate, and display device	20190723
WO-2021014856-A1	Composition, film, laminate, and display device	20190723
WO-2020048949-A1	New class of dna gyrase and/or topoisomerase iv inhibitors with activity against gram-positive and gram-negative bacteria	20180903
EP-3847172-A1	New class of dna gyrase and/or topoisomerase iv inhibitors with activity against gram-positive and gram-negative bacteria	20180903
US-2021323957-A1	New class of dna gyrase and/or topoisomerase iv inhibitors with activity against gram-positive and gram-negative bacteria	20180903

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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
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride

Complexity:	252
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	284.94591
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	284.94591
Rotatable Bond Count:	3
Topological Polar Surface Area:	67.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6