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6-Bromo-1H-benzimidazole - 97%, high purity , CAS No.4887-88-1

COA

Grade & Purity:

≥97%

Cas Number: 4887-88-1
Molecular Weight: 197.032
MDL number: MFCD00460014
PubChem CID: 785299
PubChem SID: 488191477

In stock

Item Number

B137245

Grouped product items
SKU	Size	Availability	Price
B137245-1g	1g	4	$48.90
B137245-5g	5g	5	$218.90
B137245-10g	10g	4	$392.90
B137245-25g	25g	1	$883.90
B137245-100g	100g	1	$3,178.90

View related series

Benzimidazoles (91) Halogenated heterocyclic block (1171)

Basic Description

Synonyms	GEDVWGDBMPJNEV-UHFFFAOYSA-N \| 5-Bromo-1H-benzimidazole \| 1H-Benzimidazole, 5-bromo- \| AM20040553 \| Potassium Bis(trimethylsilyl)amide, 1M THF \| 6-bromo-1H-benzo[d]imidazole \| A7356 \| F2163-0004 \| MFCD00160001 \| J-516789 \| 5-BROMOBENZIMIDAZOLE \| 5-bromo-be
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzimidazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzimidazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzimidazoles
Alternative Parents	Benzenoids Aryl bromides Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzimidazole - Benzenoid - Aryl halide - Aryl bromide - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488191477
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488191477
IUPAC Name	6-bromo-1H-benzimidazole
INCHI	InChI=1S/C7H5BrN2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,(H,9,10)
InChIKey	GEDVWGDBMPJNEV-UHFFFAOYSA-N
Smiles	C1=CC2=C(C=C1Br)NC=N2
Isomeric SMILES	C1=CC2=C(C=C1Br)NC=N2
WGK Germany	3
Molecular Weight	197.032
Reaxy-Rn	606931
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606931&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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13 results found

Lot Number	Certificate Type	Date	Item
F23271219	Certificate of Analysis	Apr 07, 2025	B137245
F23271221	Certificate of Analysis	Apr 07, 2025	B137245
F23271207	Certificate of Analysis	Apr 07, 2025	B137245
F23271215	Certificate of Analysis	Apr 07, 2025	B137245
F23271205	Certificate of Analysis	Apr 07, 2025	B137245
F23271218	Certificate of Analysis	Apr 07, 2025	B137245
F23271206	Certificate of Analysis	Apr 07, 2025	B137245
C23151081	Certificate of Analysis	Dec 11, 2024	B137245
G2429221	Certificate of Analysis	Jun 27, 2024	B137245
J2129340	Certificate of Analysis	Aug 01, 2023	B137245
J2129609	Certificate of Analysis	Aug 01, 2023	B137245
J2129341	Certificate of Analysis	Aug 01, 2023	B137245
K1513028	Certificate of Analysis	May 10, 2023	B137245

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Chemical and Physical Properties

Solubility	Soluble in Methanol
Melt Point(°C)	128 °C
Molecular Weight	197.030 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	195.964 Da
Monoisotopic Mass	195.964 Da
Topological Polar Surface Area	28.700 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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