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AG00ABO2

Name: IC 261
Brand: Angene Chemical
SKU: AG00ABO2

186611-52-9 | IC 261

Chemical structure of IC 261, CAS 186611-52-9

AG00ABO2

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CAS Number	186611-52-9
Catalog Number	AG00ABO2(AGN-PC-0JK6ME)
Chemical Name	IC 261
IUPAC Name	(3E)-3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one
InChI	InChI=1S/C18H17NO4/c1-21-11-8-16(22-2)14(17(9-11)23-3)10-13-12-6-4-5-7-15(12)19-18(13)20/h4-10H,1-3H3,(H,19,20)/b13-10+
InChI Key	JBJYTZXCZDNOJW-JLHYYAGUSA-N
MDL Number	MFCD00118156
Molecular Formula	C18H17NO4
Molecular Weight	311.3319
SMILES	COC1=C(C(=CC(=C1)OC)OC)C=C1C(NC2=CC=CC=C12)=O
Synonyms	3-((2,4,6-trimethoxyphenyl)methylidenyl)indolin-2-one, IC 261, IC-261, IC261, ic261, IC 261, SU-5607, 186611-52-9, 3-[(2,4,6-Trimethoxyphenyl)methylidenyl]-indolin-2-one, SU5607, CHEMBL489156, 3-[(2,4,6-TRIMETHOXY-PHENYL)-METHYLENE]-INDOLIN-2-ONE, MFCD00118156, (3E)-3-[(2,4,6-trimethoxyphenyl)methylidene]-1H-indol-2-one, 1,3-Dihydro-3-[(2,4,6-trimethoxyphenyl)methylene]-2H-indol-2-one, IC1, AC1NRBRK, Lopac-I-0658, 3-(2,4,6-trimethoxybenzylidene)indolin-2-one, Lopac0_001017, SCHEMBL2786157, HMS1433C06, HMS3229I10, HMS3263K15, ZINC136945, Tox21_501017, BDBM50263829, HSCI1_000024, s8237, AKOS030632794, CCG-205097, CS-4967, DB03083, LP01017, SU5607 (IC261), IDI1_012141, NCGC00015546-01, NCGC00015546-02, NCGC00015546-03, NCGC00015546-04, NCGC00094309-01, NCGC00094309-02, NCGC00261702-01, HY-12774, EU-0101017, I 0658, SR-01000075566, (E)-3-(2,4,6-trimethoxybenzylidene)indolin-2-one, J-011989, SR-01000075566-1, BRD-K09638361-001-01-4, (3E)-3-[(2,4,6-trimethoxyphenyl)methylidene]-1,3-dihydro-2H-indol-2-one, IC-261, CID5288600, C411652, 3-((2,4,6-trimethoxyphenyl)methylidenyl)indolin-2-one,

Complexity	450
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	311.116g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	311.337g/mol
Monoisotopic Mass	311.116g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	56.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited