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88961-92-6

88961-92-6 | Ethanone, 1-[5-(2-azidoethyl)-2-thienyl]-

CAS No: 88961-92-6 Catalog No: AG0047I7 MDL No:

Product Description

Catalog Number:
AG0047I7
Chemical Name:
Ethanone, 1-[5-(2-azidoethyl)-2-thienyl]-
CAS Number:
88961-92-6
Molecular Formula:
C8H9N3OS
Molecular Weight:
195.2416
IUPAC Name:
1-[5-(2-azidoethyl)thiophen-2-yl]ethanone
InChI:
InChI=1S/C8H9N3OS/c1-6(12)8-3-2-7(13-8)4-5-10-11-9/h2-3H,4-5H2,1H3
InChI Key:
IAOYYWSPIWGGKJ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NCCc1ccc(s1)C(=O)C

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.047g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.24g/mol
Monoisotopic Mass:
195.047g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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