AG002WA2

2873-29-2 | D-arabino-Hex-1-enitol, 1,5-anhydro-2-deoxy-, 3,4,6-triacetate

AG002WA2

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CAS Number	2873-29-2
Catalog Number	AG002WA2(AGN-PC-0O8LRL)
Chemical Name	D-arabino-Hex-1-enitol, 1,5-anhydro-2-deoxy-, 3,4,6-triacetate
EC Number	220-709-0
IUPAC Name	[(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate
InChI	InChI=1S/C12H16O7/c1-7(13)17-6-11-12(19-9(3)15)10(4-5-16-11)18-8(2)14/h4-5,10-12H,6H2,1-3H3/t10-,11-,12+/m1/s1
InChI Key	LLPWGHLVUPBSLP-UTUOFQBUSA-N
MDL Number	MFCD00063253
Molecular Formula	C12H16O7
Molecular Weight	272.2512
SMILES	[H]C1(OC(=O)C)(C=COC([H])(COC(=O)C)C1([H])(OC(=O)C))
Synonyms	3,4,6-tri-O-acetyl-1,5-anhydro-2-deoxy-D-arabino-hex-1-enitol, 3,4,6-tri-O-acetyl-D-glucal, 3,4,6-tri-O-acetylglucal, 2873-29-2, 3,4,6-tri-O-Acetyl-D-glucal, Tri-O-acetyl-D-glucal, (2R,3S,4R)-2-(acetoxymethyl)-3,4-dihydro-2H-pyran-3,4-diyl diacetate, D-Glucal triacetate, MFCD00063253, 3,4,6-Tri-O-acetyl-1,5-anhydro-2-deoxy-D-arabino-hex-1-enitol, Tri-O-acetyl-D-glucal, 99%, arabino-Hex-1-enitol, 1,5-anhydro-2-deoxy-, triacetate, 1,2-Dideoxy-3,4,6-tri-O-acetyl-D-arabino-1-hexenopyranose, Tri-O-acetylglucal, Triacetyl-D-glucal, tri-O-acetyl-glucal, PubChem6384, AC1LELSI, SCHEMBL62522, KSC924Q1H, Tri-O-acetyl-D-glucal, 98%, CTK8C4813, ZINC57063, LLPWGHLVUPBSLP-UTUOFQBUSA-N, s194, HMS1664N10, ANW-73222, CCG-42963, CT-030, [(2R,3S,4R)-3,4-bis(acetyloxy)-3,4-dihydro-2H-pyran-2-yl]methyl acetate, AKOS015919129, AKOS015924784, LS00008, MCULE-2900195367, RP29658, RTR-012621, AJ-09561, BC228101, CJ-00436, SC-03135, TS-00913, ZB001951, DB-005260, CS-0020143, FT-0082491, FT-0634522, ST24032034, S-1157, A819567, SR-01000632917-1, 1,5-Anhydro-2-deoxy-D-arabino-Hex-1-enitol 3,4,6-Triacetate, 3,4,6-Tri-O-acetyl-1,2-dideoxy-D-arabino-hex-1-enopyranose, 3,4,6-TRI-O-ACETYL-1,5-ANHYDRO-D-ARABINO-HEX-1-ENI, [(2R,3S,4R)-3,4-diacetoxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate, [(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate, [(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl ethanoate, 1,5-Anhydro-2-deoxy-D-arabino-hex-1-enitol 3,4,6-Tri-O-acetyl Ether, acetic acid [(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl ester, 3,4,6-Tri-O-acetylglucal, 3,4,6-Tri-O-acetyl-D-galactal, C12H16O7, EINECS 220-709-0, CID688303, ZINC00057063, ACN-049862, C12-H16-O7, CB11122, T1596, 1,5-Anhydro-2-deoxy-D-arabino-hex-1-enitol triacetate, D-Arabino-Hex-1-enopyranose, 1,2-dideoxy-, triacetate, D-arabino-Hex-1-enitol, 1,5-anhydro-2-deoxy-, triacetate, 4098-06-0,

Complexity	388
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	272.09g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	272.253g/mol
Monoisotopic Mass	272.09g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	88.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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