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Product No: AB3790

6-Bromobenzo[d]thiazole, 97%

Name: 6-Bromobenzo[d]thiazole
Brand: Chempure

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CAS Number

53218-26-1

Molecular Weight

214.08

Formula

C7H4BrNS

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About this item

IUPAC name	6-bromo-1,3-benzothiazole
canonical smiles	C1=CC2=C(C=C1Br)SC=N2
inchi	InChI=1S/C7H4BrNS/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H
inchi key	YJOUISWKEOXIMC-UHFFFAOYSA-N
molecular formula	C7H4BrNS
synonyms	6-Bromobenzothiazole 6-bromo-1,3-benzothiazole 53218-26-1 6-bromobenzo[d]thiazole 6-Bromo-benzothiazole

Computed Properties

Molecular Weight:	214.08 g/mol
XLogP3:	2.7
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	212.92478 g/mol
Monoisotopic Mass:	212.92478 g/mol
Topological Polar Surface Area:	41.1 Å²
Heavy Atom Count:	10
Formal Charge:	0
Complexity:	131
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Benzofuran

3,4-Methylenedioxyphenol

Benzothiazole

Guaiazulene

6-Methylquinoline

Methyl 2-methyl-3-furyl disulfide

Isoquinoline

2-Methylbenzothiazole

Chamazulene

3-Butylpyridine

2,6-Dimethylquinoline

8-Methylquinoline

2,3-Dihydrobenzofuran

2-Isopropylnaphthalene

(Furfurylthio)ethane

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (83.33%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Documentation

Certificate of Analysis

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: AB3790

6-Bromobenzo[d]thiazole, 97%

Product No: AB3790

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

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Documentation

Certificate of Analysis

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Product No: AB3790

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?