AG002R69

2595-05-3 | α-D-Allofuranose, 1,2:5,6-bis-O-(1-methylethylidene)-

AG002R69

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CAS Number	2595-05-3
Catalog Number	AG002R69(AGN-PC-0R1U5D)
Chemical Name	α-D-Allofuranose, 1,2:5,6-bis-O-(1-methylethylidene)-
IUPAC Name	(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
InChI	InChI=1S/C12H20O6/c1-11(2)14-5-6(16-11)8-7(13)9-10(15-8)18-12(3,4)17-9/h6-10,13H,5H2,1-4H3/t6-,7-,8-,9-,10-/m1/s1
InChI Key	KEJGAYKWRDILTF-VVULQXIFSA-N
MDL Number	MFCD00135634
Molecular Formula	C12H20O6
Molecular Weight	260.2836
SMILES	[C@H]12OC(O[C@H]1O[C@@H]([C@H]2O)[C@@H]3OC(OC3)(C)C)(C)C
Synonyms	1,2:5,6-Di-O-isopropylidene-alpha-D-allofuranose, 2595-05-3, (3aR,5S,6R,6aR)-5-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-ol, 1,2:5,6-Di-O-isopropylidene-alpha-D-allo-furanose, 98%, 1,2,5,6-di-o-isopropylidene-alpha-d-allofuranose, AK-32567, MFCD00135634, AC1OFWO5, 1,2:5,6-Di-O-isopropylidene-?-D-allofuranose, SCHEMBL210131, KEJGAYKWRDILTF-VVULQXIFSA-N, 26597-74-0, ACT01875, ZINC4262105, BI3857, CD-088, AKOS015919940, AKOS015924840, AM84846, CS-W008335, DS-0805, 1,2:5,6-bis-O-(1- methylethylidene, AJ-49844, BR-32567, SC-15323, AX8052952, ST2408406, D2265, FT-0082213, FT-0606274, 5,6-Di-O-isopropylidene-alpha-D-allofuranose, K-0019, M-1502, 595D053, 1-O,2-O:5-O,6-O-Diisopropylidene-alpha-D-allofuranose, 1,2:5,6-Di-O-isopropylidene-alpha-D-allofuranose, 98%, (3aR,5S,6R,6aR)-5-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyltetrahydrofuro[3,2-d][1,3]dioxol-6-ol, (3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol, (3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-ol, (3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol, Diacetoneglucose, )-alpha-D-Allofur anose, C12H20O6, ACN-026867, CID7157054, 1,2:5,6-Di-O-isopropylidene-a-D-allofuranose, alpha-d-Allofuranose, 1,2:5,6-bis-O-(1-methylethylidene)-,

Complexity	342
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Exact Mass	260.126g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	260.286g/mol
Monoisotopic Mass	260.126g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number