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55052-28-3

55052-28-3 | 4-Chloro-7-azaindole

CAS No: 55052-28-3 Catalog No: AG0033ZQ MDL No:MFCD08272232

Product Description

Catalog Number:
AG0033ZQ
Chemical Name:
4-Chloro-7-azaindole
CAS Number:
55052-28-3
Molecular Formula:
C7H5ClN2
Molecular Weight:
152.5810
MDL Number:
MFCD08272232
IUPAC Name:
4-chloro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H5ClN2/c8-6-2-4-10-7-5(6)1-3-9-7/h1-4H,(H,9,10)
InChI Key:
HNTZVGMWXCFCTA-UHFFFAOYSA-N
SMILES:
Clc1ccnc2c1cc[nH]2

Properties

Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.014g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.581g/mol
Monoisotopic Mass:
152.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
4-Chloro-1-(4-methyl-phenyl-sulfon-yl)-1H-pyrrolo[2,3-b]pyridine. Acta crystallographica. Section E, Structure reports online 20091201

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