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5-bromo-1-[tris(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridine - 95%, high purity , CAS No.858116-66-2

COA

Grade & Purity:

≥95%

Cas Number: 858116-66-2
Molecular Weight: 353.379
PubChem CID: 24229223
PubChem SID: 504769754

In stock

Item Number

B177681

Grouped product items
SKU	Size	Availability	Price
B177681-250mg	250mg	3	$196.90
B177681-1g	1g	3	$605.90
B177681-5g	5g	3	$2,723.90
B177681-25g	25g	3	$12,254.90

Basic Description

Synonyms	858116-66-2 \| 5-Bromo-1-(triisopropylsilyl)-1H-pyrrolo[2,3-b]pyridine \| 5-Bromo-1-triisopropylsilanyl-1H-pyrrolo[2,3-b]pyridine \| 5-bromo-1-[tris(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridine \| 5-Bromo-1-triisopropylsilanyl-1H-pyrrolo-[2,3-b]pyridine \| (5-bromopyrro
Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyrrolopyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrrolopyridines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Pyrrolopyridines
Alternative Parents	Alkylarylsilanes Substituted pyrroles Pyridines and derivatives Aryl bromides Trialkylheterosilanes Heteroaromatic compounds Organic metalloid salts N-silyl compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Pyrrolopyridine - Alkylarylsilane - Aryl bromide - Aryl halide - Pyridine - Substituted pyrrole - Trialkylheterosilane - Pyrrole - Heteroaromatic compound - N-silyl compound - Organoheterosilane - Organic metalloid salt - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organic metalloid moeity - Organohalogen compound - Organosilicon compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
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	504769754
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504769754
IUPAC Name	(5-bromopyrrolo[2,3-b]pyridin-1-yl)-tri(propan-2-yl)silane
INCHI	InChI=1S/C16H25BrN2Si/c1-11(2)20(12(3)4,13(5)6)19-8-7-14-9-15(17)10-18-16(14)19/h7-13H,1-6H3
InChIKey	UJUSITKTVXDVLQ-UHFFFAOYSA-N
Smiles	CC(C)[Si](C(C)C)(C(C)C)N1C=CC2=CC(=CN=C21)Br
Isomeric SMILES	CC(C)[Si](C(C)C)(C(C)C)N1C=CC2=CC(=CN=C21)Br
Molecular Weight	353.379
Reaxy-Rn	11432222
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11432222&ln=

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

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Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
H2223073	Certificate of Analysis	Aug 26, 2022	B177681
H2223065	Certificate of Analysis	Aug 26, 2022	B177681
H2223074	Certificate of Analysis	Aug 26, 2022	B177681
H2223600	Certificate of Analysis	Aug 26, 2022	B177681

Chemical and Physical Properties

Molecular Weight	353.370 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	352.097 Da
Monoisotopic Mass	352.097 Da
Topological Polar Surface Area	17.800 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	311.000
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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