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89221-00-1

89221-00-1 | 2H-1,2,3-Triazole, 2-ethyl-4-[4-(2-propenyloxy)phenyl]-

CAS No: 89221-00-1 Catalog No: AG0044YE MDL No:

Product Description

Catalog Number:
AG0044YE
Chemical Name:
2H-1,2,3-Triazole, 2-ethyl-4-[4-(2-propenyloxy)phenyl]-
CAS Number:
89221-00-1
Molecular Formula:
C13H15N3O
Molecular Weight:
229.2777
IUPAC Name:
2-ethyl-4-(4-prop-2-enoxyphenyl)triazole
InChI:
InChI=1S/C13H15N3O/c1-3-9-17-12-7-5-11(6-8-12)13-10-14-16(4-2)15-13/h3,5-8,10H,1,4,9H2,2H3
InChI Key:
YWORLCWNUMSEEU-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(cc1)c1cnn(n1)CC

Properties

Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.122g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.283g/mol
Monoisotopic Mass:
229.122g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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