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CAS Number: 1245649-52-8
4-chloro-5-nitro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

Structure

4-chloro-5-nitro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
Name: 4-chloro-5-nitro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
Synonyms:
General Information
Product Number: 1245649528

CAS Registry Number 1245649-52-8
Name:
1H-​Pyrrolo[2,​3-​b]​pyridine, 4-​chloro-​5-​nitro-​1-​(phenylsulfonyl)​-
1-Benzenesulfonyl-4-chloro-5-nitro-1H-pyrrolo[2,3-b]pyridine

 

Chemical Formula: C13H8ClN3O4S
Exact Mass: 336.99
Molecular Weight: 337.74
m/z: 336.99 (100.0%), 338.99 (36.7%), 338.00 (14.3%), 339.99 (5.9%), 337.99 (1.9%), 340.99 (1.9%), 339.00 (1.9%)

 

InChI:InChI=1S/C13H8ClN3O4S/c14-12-10-6-7-16(13(10)15-8-11(12)17(18)19)22(20,21)9-4-2-1-3-5-9/h1-8H

InChI Key:VDNRYINHXTYMIT-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C(C(=CN=C32)[N+](=O)[O-])Cl

Specification

98%

References

PCT Int. Appl. (2015), WO 2015015378 A2 20150205.

PCT Int. Appl. (2013), WO 2013007765 A1 20130117.                                  

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