AG001DII

145915-58-8 | 1H-Isoindole-1,3(2H)-dione, 5,6-bis(phenylamino)-

AG001DII

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CAS Number	145915-58-8
Catalog Number	AG001DII(AGN-PC-0JK5YL)
Chemical Name	1H-Isoindole-1,3(2H)-dione, 5,6-bis(phenylamino)-
EC Number	406-050-3
IUPAC Name	5,6-dianilinoisoindole-1,3-dione
InChI	InChI=1S/C20H15N3O2/c24-19-15-11-17(21-13-7-3-1-4-8-13)18(12-16(15)20(25)23-19)22-14-9-5-2-6-10-14/h1-12,21-22H,(H,23,24,25)
InChI Key	AAALVYBICLMAMA-UHFFFAOYSA-N
MDL Number	MFCD00236442
Molecular Formula	C20H15N3O2
Molecular Weight	329.3520
SMILES	O=C1NC(C2=CC(NC3=CC=CC=C3)=C(NC4=CC=CC=C4)C=C21)=O
UNII	Z13D008FZ2
Synonyms	4,5-dianilinophthalimide, CGP 52411, CGP 53353, CGP 54211, CGP-52411, CGP53353, DAPH1, DAPH, 4,5-dianilinophthalimide, Cgp 52411, 145915-58-8, Cgp-52411, 5,6-Bis(phenylamino)-1H-isoindole-1,3(2H)-dione, 5,6-Bis(phenylamino)isoindoline-1,3-dione, 5,6-dianilino-1h-isoindole-1,3(2h)-dione, UNII-Z13D008FZ2, CHEMBL268868, CHEBI:53110, Z13D008FZ2, 1H-Isoindole-1,3(2H)-dione, 5,6-bis(phenylamino)-, AC1Q6JME, DAPH-1, SCHEMBL11017, 4,5-Bis(anilino)phthalimide, 4,5-bis-(anilino)phthalimide, AC1L1C19, ZINC6094, DTXSID4040393, CTK8D4606, AAALVYBICLMAMA-UHFFFAOYSA-N, BCPP000288, HMS3260P13, HMS3677J22, 5,6-dianilinoisoindole-1,3-dione, BCP27630, CGP52411, Tox21_500236, ABP000886, BDBM50040929, DAPH, >=98% (HPLC), solid, MFCD00236442, AKOS024457581, BCP9000511, CCG-221540, LP00236, CGP 52411/CGP52411, NCGC00093700-01, NCGC00093700-02, NCGC00093700-03, NCGC00093700-04, NCGC00093700-05, NCGC00260921-01, 5,6-Bis-phenylamino-isoindole-1,3-dione, J587.895K, RT-012225, B7384, FT-0731235, J-008168, BRD-K13087974-001-01-7, nchembio.65-comp5, DAPH1, D03QTP, CID1697, CGP53353, AR-1G6110, CGP 53353, CGP 54211, A12867, C098874, 15981-91-6, 157168-02-0,

Complexity	453
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	329.116g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	329.359g/mol
Monoisotopic Mass	329.116g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	70.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H303
Packing Group
Precautionary statements	P312
UN Code

Certificate of Analysis

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