Name: Name:6,6'-Dibromo-1,1'-bis(2-ethylhexyl)-[3,3'-biindolinylidene]-2,2'-dione
Brand: Angene
SKU: AG000F3B
Rating: 90 (10 reviews)

6,6'-Dibromo-1,1'-bis(2-ethylhexyl)-[3,3'-biindolinylidene]-2,2'-dione

CAS No.:

1147124-23-9

Catalog Number:

AG000F3B

Molecular Formula:

C32H40Br2N2O2

Molecular Weight:

644.4802

Catalog Number:

AG000F3B

Chemical Name:

6,6'-Dibromo-1,1'-bis(2-ethylhexyl)-[3,3'-biindolinylidene]-2,2'-dione

CAS Number:

1147124-23-9

Molecular Formula:

C32H40Br2N2O2

Molecular Weight:

644.4802

MDL Number:

MFCD28125575

IUPAC Name:

6-bromo-3-[6-bromo-1-(2-ethylhexyl)-2-oxoindol-3-ylidene]-1-(2-ethylhexyl)indol-2-one

InChI:

InChI=1S/C32H40Br2N2O2/c1-5-9-11-21(7-3)19-35-27-17-23(33)13-15-25(27)29(31(35)37)30-26-16-14-24(34)18-28(26)36(32(30)38)20-22(8-4)12-10-6-2/h13-18,21-22H,5-12,19-20H2,1-4H3

InChI Key:

HUEXOUHCCSVYLP-UHFFFAOYSA-N

SMILES:

CCCCC(CN1C(=O)C(=C2c3ccc(cc3N(C2=O)CC(CCCC)CC)Br)c2c1cc(Br)cc2)CC

Complexity:

792

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

644.144g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

644.492g/mol

Monoisotopic Mass:

642.146g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

9.6