Name: Name:4,9-Dibromo-2,7-bis(2-ethylhexyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2h,7h)-tetraone
Brand: Angene
SKU: AG0091GS
Rating: 90 (10 reviews)

4,9-Dibromo-2,7-bis(2-ethylhexyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2h,7h)-tetraone

CAS No.:

1088205-02-0

Catalog Number:

AG0091GS

Molecular Formula:

C30H36Br2N2O4

Molecular Weight:

648.4258

Catalog Number:

AG0091GS

Chemical Name:

4,9-Dibromo-2,7-bis(2-ethylhexyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2h,7h)-tetraone

CAS Number:

1088205-02-0

Molecular Formula:

C30H36Br2N2O4

Molecular Weight:

648.4258

MDL Number:

MFCD27923032

IUPAC Name:

2,9-dibromo-6,13-bis(2-ethylhexyl)-6,13-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1,3,8,10,15-pentaene-5,7,12,14-tetrone

InChI:

InChI=1S/C30H36Br2N2O4/c1-5-9-11-17(7-3)15-33-27(35)19-13-22(32)26-24-20(14-21(31)25(23(19)24)29(33)37)28(36)34(30(26)38)16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3

InChI Key:

IMWDVKCSASRBSW-UHFFFAOYSA-N

SMILES:

CCCCC(Cn1c(=O)c2cc(Br)c3c4c2c(c1=O)c(Br)cc4c(=O)n(c3=O)CC(CCCC)CC)CC

Complexity:

841

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

648.102g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

648.436g/mol

Monoisotopic Mass:

646.104g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

8.8