AG00I9DP

5242-49-9 | Benzoxazole,2-[4-[2-[4-(2-benzoxazolyl)phenyl]ethenyl]phenyl]-5-methyl-

AG00I9DP

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CAS Number	5242-49-9
Catalog Number	AG00I9DP(AGN-PC-0SCQ6R)
Chemical Name	Benzoxazole,2-[4-[2-[4-(2-benzoxazolyl)phenyl]ethenyl]phenyl]-5-methyl-
EC Number	226-044-2
IUPAC Name	2-[4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]phenyl]-5-methyl-1,3-benzoxazole
InChI	InChI=1S/C29H20N2O2/c1-19-6-17-27-25(18-19)31-29(33-27)23-15-11-21(12-16-23)8-7-20-9-13-22(14-10-20)28-30-24-4-2-3-5-26(24)32-28/h2-18H,1H3/b8-7+
InChI Key	SOTPOQQKAUOHRO-BQYQJAHWSA-N
MDL Number	MFCD00328411
Molecular Formula	C29H20N2O2
Molecular Weight	428.4813
SMILES	CC1=CC2=C(OC(=N2)C2=CC=C(C=CC3=CC=C(C=C3)C3=NC4=C(O3)C=CC=C4)C=C2)C=C1
Synonyms	5242-49-9, Fluorescent Brightener KS-N, Fluorescent brightener KSN, 4-(2-Benzoxazolyl)-4'-(5-methyl-2-benzoxazolyl)stilbene, benzoxazole, 2-[4-[2-[4-(2-benzoxazolyl)phenyl]ethenyl]phenyl]-5-methyl-, Benzoxazole, 2-(4-(2-(4-(2-benzoxazolyl)phenyl)ethenyl)phenyl)-5-methyl-, 2-[4-[(E)-2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]phenyl]-5-methyl-1,3-benzoxazole, 2-(4-(4-(Benzo[d]oxazol-2-yl)styryl)phenyl)-5-methylbenzo[d]oxazole, (E)-2-(4-(4-(benzo[d]oxazol-2-yl)styryl)phenyl)-5-methylbenzo[d]oxazole, EINECS 226-044-2, AC1NXXXN, BAS 01056973, AC1Q4WLA, Oprea1_115110, SCHEMBL413259, 5-Methyl-2,2'-(vinylenedi-p-phenylene)bis(benzoxazole), DTXSID0063739, ZINC3146887, ZX-AT015672, MFCD00328411, 5-Methyl-2-(4-(2-(4-(2-benzoxazolyl)phenyl)ethenyl)phenyl)benzoxazole, AKOS015855805, OR52143, RTR-018604, AJ-44595, AS-17732, AX8089789, TR-018604, 242F499, A829077, C-34902, W-105828, 5-Methyl-2,2'-(vinylenedi-p-phenylene)bis-benzoxazole, 4-(2-Benzoxazolyl)-4'-(5-methyl-2-benzoxazolyl) stilbene, 4-(benzoxazol-2-yl)-4'-(5-methylbenzoxazol-2-yl)stilbene, 2-[4-[4-(2-Benzoxazolyl)styryl]phenyl]-5-methylbenzoxazole, 2-(4-(2-(4-(Benzoxazol-2-yl)phenyl)vinyl)phenyl)-5-methylbenzoxazole, 2-(4-(4-(Benzo[d]oxazol-2-yl)styryl)-phenyl)-5-methylbenzo[d]oxazole, 2-[4-[2-[4-(2-Benzoxazolyl)phenyl]ethenyl]phenyl]-5-methyl-benzoxazol, 2-{4-[2-(4-Benzooxazol-2-yl-phenyl)-vinyl]-phenyl}-5-methyl-benzooxazole, Benzoxazole,2-[4-[2-[4-(2-benzoxazolyl)phenyl]ethenyl]phenyl]-5-methyl-, C29H20N2O2, AR-1H9390, C29-H20-N2-O2, CID5761588, 4-(2-benzoxazolyl)-4-(5-methyl-2-benzoxazolyl)stilbene, 2-[4-[2-[4-(benzoxazol-2-yl)phenyl]vinyl]phenyl]-5-methylbenzoxazole, Benzoxazole, 2-[4-[2-[4-(2-benzoxazolyl) phenyl]ethenyl]phenyl]-5-methyl-, 5340-62-5,

Complexity	667
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	428.152g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	428.491g/mol
Monoisotopic Mass	428.152g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number