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67014-83-9

67014-83-9 | Benzoxazole, 2-[2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]ethenyl]-

CAS No: 67014-83-9 Catalog No: AG0064K8 MDL No:

Product Description

Catalog Number:
AG0064K8
Chemical Name:
Benzoxazole, 2-[2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]ethenyl]-
CAS Number:
67014-83-9
Molecular Formula:
C18H13N3O2
Molecular Weight:
303.3147
IUPAC Name:
2-[2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]ethenyl]-1,3-benzoxazole
InChI:
InChI=1S/C18H13N3O2/c1-12-19-18(23-21-12)14-9-6-13(7-10-14)8-11-17-20-15-4-2-3-5-16(15)22-17/h2-11H,1H3
InChI Key:
DVTLEDQXEBARDV-UHFFFAOYSA-N
SMILES:
Cc1noc(n1)c1ccc(cc1)C=Cc1nc2c(o1)cccc2

Properties

Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.101g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.321g/mol
Monoisotopic Mass:
303.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
4.3  

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