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218301-40-7

218301-40-7 | Isoquinoline, 7-azido-

CAS No: 218301-40-7 Catalog No: AG006Z4O MDL No:

Product Description

Catalog Number:
AG006Z4O
Chemical Name:
Isoquinoline, 7-azido-
CAS Number:
218301-40-7
Molecular Formula:
C9H6N4
Molecular Weight:
170.1707
IUPAC Name:
7-azidoisoquinoline
InChI:
InChI=1S/C9H6N4/c10-13-12-9-2-1-7-3-4-11-6-8(7)5-9/h1-6H
InChI Key:
WWNQKPVKQSUGCZ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1ccc2c(c1)cncc2

Properties

Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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