AG00G54L

852821-06-8 | (4aS,8aS,9S)-3-(benzyloxy)-4a-[(tert-butyldimethylsilyl)oxy]-9-(dimethylamino)-8H,8aH,9H-naphtho[2,3-d][1,2]oxazole-4,5-dione

AG00G54L

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CAS Number	852821-06-8
Catalog Number	AG00G54L(AGN-PC-0UZIH9)
Chemical Name	(4aS,8aS,9S)-3-(benzyloxy)-4a-[(tert-butyldimethylsilyl)oxy]-9-(dimethylamino)-8H,8aH,9H-naphtho[2,3-d][1,2]oxazole-4,5-dione
IUPAC Name	(4aS,8aS,9S)-4a-[tert-butyl(dimethyl)silyl]oxy-9-(dimethylamino)-3-phenylmethoxy-8a,9-dihydro-8H-benzo[f][1,2]benzoxazole-4,5-dione
InChI	InChI=1S/C26H34N2O5Si/c1-25(2,3)34(6,7)33-26-18(14-11-15-19(26)29)21(28(4)5)22-20(23(26)30)24(27-32-22)31-16-17-12-9-8-10-13-17/h8-13,15,18,21H,14,16H2,1-7H3/t18-,21-,26-/m0/s1
InChI Key	SLXLVVLJLQJWFG-JCWFFFCVSA-N
MDL Number	MFCD28023585
Molecular Formula	C26H34N2O5Si
Molecular Weight	482.6441
SMILES	O=C([C@]12O[Si](C(C)(C)C)(C)C)C3=C(ON=C3OCC4=CC=CC=C4)[C@H]([C@@]1(CC=CC2=O)[H])N(C)C
Synonyms	852821-06-8, TP808, TP-808, (4aS,8aS,9S)-3-(benzyloxy)-4a-((tert-butyldimethylsilyl)oxy)-9-(dimethylamino)-8a,9-dihydronaphtho[2,3-d]isoxazole-4,5(4aH,8H)-dione, (4aS,8aS,9S)-3-(benzyloxy)-4a-(tert-butyldimethylsilyloxy)-9-(dimethylamino)-8a,9-dihydronaphtho[2,3-d]isoxazole-4,5(4aH,8H)-dione, AK341045, SCHEMBL6125122, KS-00000LFF, EX-A325, BCP08232, MFCD28023585, AKOS027338721, ZINC195972651, ACN-037653, BC600489, DS-12237, B5923, FT-0771514, (4aS,8aS,9S)-3-(benzyloxy)-4a-[(tert-butyldimethylsilyl)oxy]-9-(dimethylamino)-4H,4aH,5H,8H,8aH,9H-naphtho[2,3-d][1,2]oxazole-4,5-dione, (4aS,8aS,9S)-3-(benzyloxy)-4a-[(tert-butyldimethylsilyl)oxy]-9-(dimethylamino)-8H,8aH,9H-naphtho[2,3-d][1,2]oxazole-4,5-dione, 8aalpha,9-Dihydro-3-(benzyloxy)-4aalpha-(tert-butyldimethylsilyloxy)-9alpha-(dimethylamino)naphtho[2,3-d]isoxazole-4,5(4aH,8H)-dione, Naphth[2,3-d]isoxazole-4,5(4aH,8H)-dione, 9-(dimethylamino)-4a-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-8a,9-dihydro-3-(phenylmethoxy)-, (4aS,8aS,9S)-, SLXLVVLJLQJWFG-JCWFFFCVSA-N, CID11363682, CID 11363682, A13230,

Complexity	817
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	482.224g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	482.652g/mol
Monoisotopic Mass	482.224g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	81.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

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