200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 87769-46-8
87769-46-8 | 4H-1,3-Dioxin-4-one, 2,2-dimethyl-5-phenyl-6-(phenylmethyl)-
CAS No: 87769-46-8 Catalog No: AG004LCZ MDL No:
Product Description
Catalog Number:
AG004LCZ
Chemical Name:
4H-1,3-Dioxin-4-one, 2,2-dimethyl-5-phenyl-6-(phenylmethyl)-
CAS Number:
87769-46-8
Molecular Formula:
C19H18O3
Molecular Weight:
294.3444
IUPAC Name:
6-benzyl-2,2-dimethyl-5-phenyl-1,3-dioxin-4-one
InChI:
InChI=1S/C19H18O3/c1-19(2)21-16(13-14-9-5-3-6-10-14)17(18(20)22-19)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChI Key:
VBAIRIGKCFAJPP-UHFFFAOYSA-N
SMILES:
O=C1OC(C)(C)OC(=C1c1ccccc1)Cc1ccccc1
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.35g/mol
Monoisotopic Mass:
294.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.