200,000+ products from a single source!
sales@angenechem.com
5176-14-7 | 3-Phenyl-2,1-benzisoxazole
CAS No: 5176-14-7 Catalog No: AG00E0O3 MDL No:
Product Description
Catalog Number:
AG00E0O3
Chemical Name:
3-Phenyl-2,1-benzisoxazole
CAS Number:
5176-14-7
IUPAC Name:
3-phenyl-2,1-benzoxazole
InChI:
InChI=1S/C13H9NO/c1-2-6-10(7-3-1)13-11-8-4-5-9-12(11)14-15-13/h1-9H
InChI Key:
HTNPXVDBSMVQMI-UHFFFAOYSA-N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.068g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.221g/mol
Monoisotopic Mass:
195.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| 2-(2,1-benzoxazol-3-yl)-3,5-dimethoxyphenol and 3-phenyl-2,1-benzoxazole. | Acta crystallographica. Section C, Crystal structure communications 20030901 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.