AG0032LO

96-26-4 | 1,3-Dihydroxyacetone

AG0032LO

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CAS Number	96-26-4
Catalog Number	AG0032LO(AGN-PC-0JK5NA)
Chemical Name	1,3-Dihydroxyacetone
EC Number	202-494-5
FEMA Number	4033
IUPAC Name	1,3-dihydroxypropan-2-one
InChI	InChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2
InChI Key	RXKJFZQQPQGTFL-UHFFFAOYSA-N
MDL Number	MFCD00004670
Molecular Formula	C3H6O3
Molecular Weight	90.0779
NSC Number	24343
SMILES	OCC(=O)CO
UNII	O10DDW6JOO
Synonyms	1,3 Dihydroxy 2 Propanone, 1,3-Dihydroxy-2-Propanone, Chromelin, Dihydroxyacetone, Vitadye, 1,3-dihydroxyacetone, Dihydroxyacetone, 96-26-4, 1,3-Dihydroxypropan-2-one, Chromelin, 1,3-Dihydroxy-2-propanone, glycerone, Triulose, Viticolor, Dihyxal, Oxantin, Oxatone, Soleal, Otan, 2-Propanone, 1,3-dihydroxy-, 1,3-Dihydroxypropanone, 1,3-Dihydroxydimethyl ketone, NSC-24343, Ketochromin, Bis(hydroxymethyl) ketone, dihydroxy-acetone, UNII-O10DDW6JOO, 2-Propanone, 1,3-dihydroxy, BRN 1740268, CCRIS 4899, AI3-24477, Dihydroxyacetone [USP], EINECS 202-494-5, O10DDW6JOO, 1,2-Dihydroxy-2-propanone, CHEBI:16016, RXKJFZQQPQGTFL-UHFFFAOYSA-N, AK-46682, Dihydroxyacetone (USP), Vitadye, J-503909, Q-101302, 2HA, dihydroxyacetone (monomer), Protosol, Aliphatic ketone, HSDB 7513, Chromelin (TN), MFCD00004670, 1,3-Dihydroxyaceton, 1.3-dihydroxyacetone, a,a'-Dihydroxyacetone, PubChem4053, 1,3-dihyroxy-acetone, 1,3-dihydroxy-acetone, DIHYDROXY ACETONE, 1,3-propanediol-2-one, 2-Propanone,3-dihydroxy-, bmse000144, EC 202-494-5, alpha,alpha'-dihydroxyacetone, 1, 3-dihydroxypropan-2-one, 1,3-dihydroxy propan-2-one, 4-01-00-04119 (Beilstein Handbook Reference), KSC493Q7J, 1,3-Dihydroxyacetone (DHA), AC1L19R8, CHEMBL1229937, CTK3J3874, EBD12067, NSC24343, ANW-40801, CD0043, ZINC84397769, AKOS005259385, CS-W019614, DB01775, FCH1116763, GS-3764, LS-2005, LS41177, RP18530, RTC-063797, KS-0000026A, AN-24341, BC200545, BR-46682, CJ-22211, SC-07450, SY038299, AB1002319, AJ-126303, AX8125085, ST2408455, TC-063797, FT-0649652, V2093, MFCD00004670 (97%), C00184, D07841, 1,3-Dihydroxyacetonedimer; Dihydroxyacetone dimer, I14-0225, I14-9202, F0001-2767, 08CB5E10-C843-45EE-8556-4313C8E0BEA2, InChI=1/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H, glycerol, 1,3-Dihydroxyacetone dimer, 1,3-Propandiol-2-on, 1, 3- dihydroxyacetone, D09KDV, 1,1-dihydroxypropan-2-one, 1,3 Dihydroxy 2 Propanone, C3H6O3, CID670, C3-H6-O3, ACN-031761, Dihydroxyacetone, 98% - 250G 250g, D004098, 62147-49-3, DHA, 26776-70-5, 56-04-2, GOL,

Complexity	44
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	90.032g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	90.078g/mol
Monoisotopic Mass	90.032g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number