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199277-23-1

199277-23-1 | Benzene, 1-azido-2-(2-phenylethynyl)-

CAS No: 199277-23-1 Catalog No: AG002BZV MDL No:

Product Description

Catalog Number:
AG002BZV
Chemical Name:
Benzene, 1-azido-2-(2-phenylethynyl)-
CAS Number:
199277-23-1
Molecular Formula:
C14H9N3
Molecular Weight:
219.2414
IUPAC Name:
1-azido-2-(2-phenylethynyl)benzene
InChI:
InChI=1S/C14H9N3/c15-17-16-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-9H
InChI Key:
YKBGFFWGZZUUKZ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1ccccc1C#Cc1ccccc1

Properties

Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.247g/mol
Monoisotopic Mass:
219.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
14.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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