AC1O5ANS

disodium;1-amino-4-[3-(2-bromoprop-2-enoylamino)-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate

Also Known As: EINECS 265-515-7|Disodium 1-amino-4-((3-((2-bromo-1-oxoallyl)amino)-2,4,6-trimethyl-5-sulphonatophenyl)amino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate|2-Anthracenesulfonic acid, 1-amino-4-[[3-[(2-bromo-1-oxo-2-propenyl)amino]-2,4,6-trimethyl-5-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-, disodium salt|2-Anthracenesulfonicacid,1-amino-4-[[3-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2,4,6-trimethyl-5-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-,sodium salt (1:2)|265-515-7|benzyl N-[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxochromen-7-yl)amino]pentanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate|Disodium 1-amino-4-[[3-[(2-bromo-1-oxoallyl)amino]-2,4,6-trimethyl-5-sulphonatophenyl]amino]-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate|Disodium 1-amino-4-[3-(2-bromoprop-2-enamido)-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate|disodium 1-amino-4-[3-(2-bromoprop-2-enoylamino)-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate|disodium,1-amino-4-[3-(2-bromoprop-2-enoylamino)-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate

Molecular Formula	C26H20BrN3Na2O9S2
Molecular Weight	706.962 g/mol
LogP	-2.62364
Topological Polar Surface Area	215.69 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	11
Rotatable Bonds	6
Exact Mass	706.962
Monoisotopic Mass	706.962
Heavy Atoms	43
Complexity	1980.0148

Chemical Identifiers

CAS Number	65147-24-2
SMILES	CC1=C(C(=C(C(=C1NC(=O)C(=C)Br)C)S(=O)(=O)[O-])C)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+].[Na+]