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2-chloro-5H-pyrrolo[3,2-d]pyrimidine - 97%, high purity , CAS No.1119280-66-8

COA

Grade & Purity:

≥97%

Cas Number: 1119280-66-8
Molecular Weight: 153.57
PubChem CID: 45789986

In stock

Item Number

C172068

Grouped product items
SKU	Size	Availability	Price
C172068-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$70.90
C172068-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
C172068-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$52.90

View related series

Heterocyclic block (497)

Basic Description

Synonyms	MFCD11869949 \| PB10966 \| 2-Chloro-1H-pyrrolo[3,2-d]pyrimidine \| W-204761 \| LWPPASWKWXDDFK-UHFFFAOYSA-N \| SCHEMBL1674311 \| FT-0648345 \| AKOS015850506 \| 1119280-66-8 \| J-508839 \| AM20080067 \| 1934762-57-8 \| DTXSID40672149 \| 2-Chloro-5H-pyrrolo[3,2-d]pyrimid
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Argon charged
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 Pyrrolopyrimidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrrolopyrimidines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Pyrrolopyrimidines
Alternative Parents	2-halopyrimidines Aryl chlorides Pyrroles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Pyrrolopyrimidine - 2-halopyrimidine - Halopyrimidine - Pyrimidine - Aryl halide - Aryl chloride - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
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	2-chloro-5H-pyrrolo[3,2-d]pyrimidine
INCHI	InChI=1S/C6H4ClN3/c7-6-9-3-5-4(10-6)1-2-8-5/h1-3,8H
InChIKey	LWPPASWKWXDDFK-UHFFFAOYSA-N
Smiles	C1=CNC2=CN=C(N=C21)Cl
Isomeric SMILES	C1=CNC2=CN=C(N=C21)Cl
Molecular Weight	153.57
Reaxy-Rn	19182007
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19182007&ln=

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

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Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
F2510411	Certificate of Analysis	Oct 29, 2024	C172068
F2510412	Certificate of Analysis	Oct 29, 2024	C172068
F2510467	Certificate of Analysis	Oct 29, 2024	C172068
F2510495	Certificate of Analysis	Oct 29, 2024	C172068
F2510496	Certificate of Analysis	Oct 29, 2024	C172068
F2510497	Certificate of Analysis	Oct 29, 2024	C172068

Chemical and Physical Properties

Molecular Weight	153.570 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	153.009 Da
Monoisotopic Mass	153.009 Da
Topological Polar Surface Area	41.600 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	130.000
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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