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3‐bromo‐5‐methoxy‐1H‐pyrrolo[2,3‐b]pyridine - 97%, high purity , CAS No.1053655-76-7

COA

Grade & Purity:

≥97%

Cas Number: 1053655-76-7
Molecular Weight: 227.058
PubChem CID: 37818799

In stock

Item Number

B171840

Grouped product items
SKU	Size	Availability	Price
B171840-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$39.90
B171840-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$131.90
B171840-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$395.90

Discover 3‐bromo‐5‐methoxy‐1H‐pyrrolo[2,3‐b]pyridine by Aladdin Scientific in 97% for only $39.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-Bromo-5-methoxy-1H-pyrrolo[2,3-b]pyridine \| 1053655-76-7 \| 3-BROMO-5-METHOXY-7-AZAINDOLE \| MFCD10699216 \| SCHEMBL1047222 \| AMY7308 \| DTXSID20653330 \| ORLBCCYCMDWJEF-UHFFFAOYSA-N \| BCP23737 \| AKOS015835851 \| PB39479 \| DS-15436 \| SY097502 \| I10049 \| EN300-3173777
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

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	Alkyl aryl ethers Substituted pyrroles Pyridines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Pyrrolopyridine - Alkyl aryl ether - Aryl bromide - Aryl halide - Pyridine - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Ether - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen 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

IUPAC Name	3-bromo-5-methoxy-1H-pyrrolo[2,3-b]pyridine
INCHI	InChI=1S/C8H7BrN2O/c1-12-5-2-6-7(9)4-11-8(6)10-3-5/h2-4H,1H3,(H,10,11)
InChIKey	ORLBCCYCMDWJEF-UHFFFAOYSA-N
Smiles	COC1=CC2=C(NC=C2Br)N=C1
Isomeric SMILES	COC1=CC2=C(NC=C2Br)N=C1
Molecular Weight	227.058
Reaxy-Rn	21003876
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21003876&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	227.060 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	225.974 Da
Monoisotopic Mass	225.974 Da
Topological Polar Surface Area	37.900 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	167.000
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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