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16155-55-8

16155-55-8 | Benzoxazole, 2-(3,4-dimethylphenyl)-

CAS No: 16155-55-8 Catalog No: AG001VOL MDL No:

Product Description

Catalog Number:
AG001VOL
Chemical Name:
Benzoxazole, 2-(3,4-dimethylphenyl)-
CAS Number:
16155-55-8
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
2-(3,4-dimethylphenyl)-1,3-benzoxazole
InChI:
InChI=1S/C15H13NO/c1-10-7-8-12(9-11(10)2)15-16-13-5-3-4-6-14(13)17-15/h3-9H,1-2H3
InChI Key:
VTKOFHKKQRPKTG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1C)c1nc2c(o1)cccc2

Properties

Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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