200,000+ products from a single source!

sales@angenechem.com

Home > Oxazole > 116059-22-4

116059-22-4

116059-22-4 | Oxazole, 4,5-dihydro-4,4-dimethyl-2-[2-(phenylsulfonyl)ethenyl]-

CAS No: 116059-22-4 Catalog No: AG000BIU MDL No:

Product Description

Catalog Number:
AG000BIU
Chemical Name:
Oxazole, 4,5-dihydro-4,4-dimethyl-2-[2-(phenylsulfonyl)ethenyl]-
CAS Number:
116059-22-4
Molecular Formula:
C13H15NO3S
Molecular Weight:
265.3281
IUPAC Name:
2-[2-(benzenesulfonyl)ethenyl]-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C13H15NO3S/c1-13(2)10-17-12(14-13)8-9-18(15,16)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3
InChI Key:
QZOTWIBMBAGUOW-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)C=CS(=O)(=O)c1ccccc1

Properties

Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.077g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.327g/mol
Monoisotopic Mass:
265.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.4  

Related Products

© 2019 Angene International Limited. All rights Reserved.