200,000+ products from a single source!
sales@angenechem.com
877862-70-9 | Isoxazole, 5-(5-chloro-2-fluorophenyl)-2,3-dihydro-3-methyl-3-phenyl-
CAS No: 877862-70-9 Catalog No: AG004KY9 MDL No:
Product Description
Catalog Number:
AG004KY9
Chemical Name:
Isoxazole, 5-(5-chloro-2-fluorophenyl)-2,3-dihydro-3-methyl-3-phenyl-
CAS Number:
877862-70-9
Molecular Formula:
C16H13ClFNO
Molecular Weight:
289.7319
IUPAC Name:
5-(5-chloro-2-fluorophenyl)-3-methyl-3-phenyl-2H-1,2-oxazole
InChI:
InChI=1S/C16H13ClFNO/c1-16(11-5-3-2-4-6-11)10-15(20-19-16)13-9-12(17)7-8-14(13)18/h2-10,19H,1H3
InChI Key:
CXWRPBXBCYCWHY-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C1=CC(NO1)(C)c1ccccc1)F
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.067g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.734g/mol
Monoisotopic Mass:
289.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.