200,000+ products from a single source!
sales@angenechem.com
77854-04-7 | Ethanone, 1-[3-(diphenylmethyl)-5-methyl-4-isoxazolyl]-
CAS No: 77854-04-7 Catalog No: AG005RJU MDL No:
Product Description
Catalog Number:
AG005RJU
Chemical Name:
Ethanone, 1-[3-(diphenylmethyl)-5-methyl-4-isoxazolyl]-
CAS Number:
77854-04-7
Molecular Formula:
C19H17NO2
Molecular Weight:
291.3438
IUPAC Name:
1-(3-benzhydryl-5-methyl-1,2-oxazol-4-yl)ethanone
InChI:
InChI=1S/C19H17NO2/c1-13(21)17-14(2)22-20-19(17)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,18H,1-2H3
InChI Key:
YBLUZVFVGIMJLU-UHFFFAOYSA-N
SMILES:
CC(=O)c1c(C)onc1C(c1ccccc1)c1ccccc1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.35g/mol
Monoisotopic Mass:
291.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.