AG002JAQ

20780-75-0 | 1H-Indole-2,3-dione, 4-iodo-

AG002JAQ

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CAS Number	20780-75-0
Catalog Number	AG002JAQ(AGN-PC-0N7Y1A)
Chemical Name	1H-Indole-2,3-dione, 4-iodo-
IUPAC Name	4-iodo-1H-indole-2,3-dione
InChI	InChI=1S/C8H4INO2/c9-4-2-1-3-5-6(4)7(11)8(12)10-5/h1-3H,(H,10,11,12)
InChI Key	NYWOXCHAPWQNFC-UHFFFAOYSA-N
MDL Number	MFCD03427300
Molecular Formula	C8H4INO2
Molecular Weight	273.0273
SMILES	O=C1NC2=C(C(I)=CC=C2)C1=O
Synonyms	4-Iodoindoline-2,3-dione, 20780-75-0, 4-iodo-1H-indole-2,3-dione, 4-IODOISATIN, 4-iodo-2,3-dihydro-1H-indole-2,3-dione, 1H-Indole-2,3-dione, 4-iodo-, 4-iodo-1H-indole-2,3dione, SCHEMBL2838571, CTK4E5088, DTXSID70442857, NYWOXCHAPWQNFC-UHFFFAOYSA-N, KS-00000C6L, ZINC2585421, ANW-47996, MFCD03427300, AKOS005071396, MB02863, MCULE-7390210407, RP00214, AC-29850, AJ-43518, AK-78948, AM807772, BR-78948, SY033894, AB0023330, DB-022212, TR-009748, FT-0680735, ST24029134, W4363, MFCD03427300 (95%), 9P-718, C-4414, I10-1355, W-206555, C8H4INO2, BUTTPARK148\07-01, CID10635951, 20780-77-2,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	272.929g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	273.029g/mol
Monoisotopic Mass	272.929g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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

Lot Number