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19225-39-9 | 1H-Indene-1,3(2H)-dione, 2-bromo-2-[2-(4-bromophenyl)-2-phenylacetyl]-
CAS No: 19225-39-9 Catalog No: AG002FSU MDL No:
Product Description
Catalog Number:
AG002FSU
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-bromo-2-[2-(4-bromophenyl)-2-phenylacetyl]-
CAS Number:
19225-39-9
Molecular Formula:
C23H14Br2O3
Molecular Weight:
498.1635
IUPAC Name:
2-bromo-2-[2-(4-bromophenyl)-2-phenylacetyl]indene-1,3-dione
InChI:
InChI=1S/C23H14Br2O3/c24-16-12-10-15(11-13-16)19(14-6-2-1-3-7-14)22(28)23(25)20(26)17-8-4-5-9-18(17)21(23)27/h1-13,19H
InChI Key:
OBJIHYSWWHSWDL-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(C(=O)C1(Br)C(=O)c2c(C1=O)cccc2)c1ccccc1
Properties
Complexity:
608
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
497.929g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
498.17g/mol
Monoisotopic Mass:
495.931g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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