AG0017MF

1226782-13-3 | Benzo[1,2-b:4,5-b']dithiophene, 2,6-dibromo-4,8-bis[(2-ethylhexyl)oxy]-

AG0017MF

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CAS Number	1226782-13-3
Catalog Number	AG0017MF(AGN-PC-093FH6)
Chemical Name	Benzo[1,2-b:4,5-b']dithiophene, 2,6-dibromo-4,8-bis[(2-ethylhexyl)oxy]-
IUPAC Name	2,6-dibromo-4,8-bis(2-ethylhexoxy)thieno[2,3-f][1]benzothiole
InChI	InChI=1S/C26H36Br2O2S2/c1-5-9-11-17(7-3)15-29-23-19-13-21(27)32-26(19)24(20-14-22(28)31-25(20)23)30-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3
InChI Key	HMHJSVWOWIHEIP-UHFFFAOYSA-N
MDL Number	MFCD17018552
Molecular Formula	C26H36Br2O2S2
Molecular Weight	604.5008
SMILES	CCCCC(CC)COC1=C2SC(Br)=CC2=C(OCC(CC)CCCC)C2=C1C=C(Br)S2
Synonyms	1226782-13-3, 2,6-Dibromo-4,8-bis((2-ethylhexyl)oxy)benzo[1,2-b:4,5-b']dithiophene, AK123221, 2,6-Dibromo-4,8-bis(2-ethylhexyloxy)benzo[1,2-b:4,5-b']dithiophene, 2,6-dibromo-4,8-bis[(2-ethylhexyl)oxy]benzo[1,2-b:4,5-b']dithiophene, HMHJSVWOWIHEIP-UHFFFAOYSA-N, C26H36Br2O2S2, SCHEMBL14972943, DTXSID90679840, KS-00000R6O, 4306AA, MFCD17018552, 2,6-dibromo-4,8-bis(2-ethylhexyloxy)benzo [1,2-b,4,5-b2]-di-thiophene, 2,6-dibromo-4,8-bis[(2-ethylhexyl) oxy]-Benzo[1,2-b:4,5-b']dithiophene, DS-6903, SC-99390, AX8247399, DB-062077, D4524, FT-0757987, ST24038795, 2,6-Dibromo-4,8-bis((2-ethylhexyl)oxy)benzo[1,2-b, 2,6-Dibromo-4,8-bis[(2-ethylhexyl)oxy]-benzo[1,2-b, 2,6-Dibromo-4,8-bis((2-ethylhexyl)oxy)benzo[1,2-b:4,5-b\']dithiophene, 2,6-Dibromo-4,8-bis[(2-ethylhexyl)oxy]benzo[1,2-b:4,5-b']bisthiophene, 2,6-Dibromo-4,8-di(2-ethylhexyloxy)-benzo[1,2-b :4,5-b']dithiophene, 2,6-Dibromo-4,8-di(2-ethylhexyloxy)benzo[1,2-b:4,5-b']dithiophene, 2,6-Dibromo-4,8-bis[(2-ethylhexyl)oxy]-benzo[1,2-b:4,5-b']dithiophene,

Complexity	494
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	604.05g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	604.5g/mol
Monoisotopic Mass	602.052g/mol
Rotatable Bond Count	14
Topological Polar Surface Area	74.9A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	12.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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