200,000+ products from a single source!
sales@angenechem.com
88406-96-6 | 2-Butene-1,4-dione, 2-(4-bromophenyl)-1,4-bis(4-methylphenyl)-
CAS No: 88406-96-6 Catalog No: AG004F3E MDL No:
Product Description
Catalog Number:
AG004F3E
Chemical Name:
2-Butene-1,4-dione, 2-(4-bromophenyl)-1,4-bis(4-methylphenyl)-
CAS Number:
88406-96-6
Molecular Formula:
C24H19BrO2
Molecular Weight:
419.3105
IUPAC Name:
2-(4-bromophenyl)-1,4-bis(4-methylphenyl)but-2-ene-1,4-dione
InChI:
InChI=1S/C24H19BrO2/c1-16-3-7-19(8-4-16)23(26)15-22(18-11-13-21(25)14-12-18)24(27)20-9-5-17(2)6-10-20/h3-15H,1-2H3
InChI Key:
SCEQTTDQYFKVJW-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=CC(=O)c1ccc(cc1)C)C(=O)c1ccc(cc1)C
Properties
Complexity:
543
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.057g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
419.318g/mol
Monoisotopic Mass:
418.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.