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2-chloro-7-iodo-5-(triphenylmethyl)-5H-pyrrolo[2,3-b]pyrazine - 97%, high purity , CAS No.1509941-37-0

COA

Grade & Purity:

≥97%

Cas Number: 1509941-37-0
Molecular Weight: 521.79
PubChem CID: 118988252

In stock

Item Number

C629485

Grouped product items
SKU	Size	Availability	Price
C629485-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$179.90
C629485-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$741.90
C629485-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,481.90

Basic Description

Synonyms	1509941-37-0 \| 2-Chloro-7-iodo-5-trityl-5H-pyrrolo[2,3-b]pyrazine \| 2-chloro-7-iodo-5-(triphenylmethyl)-5H-pyrrolo[2,3-b]pyrazine \| MFCD27987778 \| SB15758 \| D79108
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyrrolopyrazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrrolopyrazines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Pyrrolopyrazines
Alternative Parents	Substituted pyrroles Pyrazines Benzene and substituted derivatives Secondary ketimines Pyrrolines Heteroaromatic compounds Vinyl iodides Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Iodoalkenes Chloroalkenes Carboximidamides Azacyclic compounds Amidines Organopnictogen compounds Organoiodides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Pyrrolopyrazine - Benzenoid - Substituted pyrrole - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Secondary ketimine - Pyrroline - Pyrrole - Ketimine - Azacycle - Iodoalkene - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Vinyl iodide - Vinyl halide - Vinyl chloride - Amidine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organoiodide - Organochloride - Organohalogen compound - Imine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as pyrrolopyrazines. These are compounds containing a pyrrolopyrazine moiety, which consists of a pyrrole ring fused to a pyrazine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazine is a 6-membered ring consisting of six carbon atoms and two nitrogen centers at ring positions 1 and 4.
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-7-iodo-5-tritylpyrrolo[2,3-b]pyrazine
INCHI	InChI=1S/C25H17ClIN3/c26-22-16-28-24-23(29-22)21(27)17-30(24)25(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H
InChIKey	SFQZQKNAOGXXNJ-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(C5=NC(=CN=C54)Cl)I
PubChem CID	118988252
Molecular Weight	521.79

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	521.799 g/mol
XLogP3	6.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	521.016 Da
Monoisotopic Mass	521.016 Da
Topological Polar Surface Area	30.700 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	511.000
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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