AG0083NK

110567-22-1 | (1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)methyl)-6-oxabicyclo[3.1.0]hexane

AG0083NK

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CAS Number	110567-22-1
Catalog Number	AG0083NK(AGN-PC-0P0TEB)
Chemical Name	(1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)methyl)-6-oxabicyclo[3.1.0]hexane
IUPAC Name	(1S,2R,3S,5R)-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-oxabicyclo[3.1.0]hexane
InChI	InChI=1S/C20H22O3/c1-3-7-15(8-4-1)12-21-14-17-18(11-19-20(17)23-19)22-13-16-9-5-2-6-10-16/h1-10,17-20H,11-14H2/t17-,18+,19-,20+/m1/s1
InChI Key	YPDRJNPIGFCETD-WCIQWLHISA-N
MDL Number	MFCD09750952
Molecular Formula	C20H22O3
Molecular Weight	310.3869
SMILES	[H][C@]12[C@H](COCC3=CC=CC=C3)[C@@H](OCC4=CC=CC=C4)C[C@@]1([H])O2
Synonyms	110567-22-1, (1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)methyl)-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane, [1S-(1|A,2|A,3|A,5|A)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(Phenymethyloxy)-2-(phenylmethoxy)methyl-6-oxabicyclo[3.1.0]hexane, YPDRJNPIGFCETD-WCIQWLHISA-N, SCHEMBL2531282, CTK8B4864, DTXSID40454442, ANW-46553, CP0014, MFCD09750952, RW2434, ZINC22065835, AKOS015918406, AC-5918, FCH3999173, (1S,2R,3S,5R)-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-oxabicyclo[3.1.0]hexane, 6-Oxabicyclo[3,1,0]hexane-3-(phenylmetyoxy)-2-[(phenylmethoxy)methyl]-(1S,2R,3S,5R), AJ-80937, AK-29771, AN-10511, AS-19494, AX8017513, RT-011015, ST2402121, R3-03, X8951, 567P221, I14-8284, W-204743, (1R,3S,4R,5S)-3-benzyloxy-4-(benzyloxymethyl)-6-oxabicyclo[3.1.0]hexane, (1alpha,5alpha)-2alpha-[(Benzyloxy)methyl]-3beta-(benzyloxy)-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(benzyloxy)-2-(benzyloxymethyl)-6-oxabicyclo[3.1.0]hexane, (1S,2R,3S,5R)-3-(benzyloxy)-2-[(benzyloxy)methyl]-6-oxa hexagon[3.1.0]hexane, (1S,2R,3S,5R)-3-(Phenylmethoxy)-2 -[(phenylmethoxy)methyl]-6- oxabicyclo[3.1.0]hexane, Entecavir intermediates E, C20H22O3, 4,6-bis (octylthiomethyl)-o-cresol, ACN-048291, CID11077786, 6-Oxabicyclo[3.1.0]hexane, 3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]-, (1S,2R,3S,5R)-,

Complexity	360
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	310.157g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	310.393g/mol
Monoisotopic Mass	310.157g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	31A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number