AG003BX9

37031-30-4 | (4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester

AG003BX9

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CAS Number	37031-30-4
Catalog Number	AG003BX9(AGN-PC-0RD68G)
Chemical Name	(4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester
IUPAC Name	dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
InChI	InChI=1S/C9H14O6/c1-9(2)14-5(7(10)12-3)6(15-9)8(11)13-4/h5-6H,1-4H3/t5-,6-/m0/s1
InChI Key	ROZOUYVVWUTPNG-WDSKDSINSA-N
MDL Number	MFCD00040504
Molecular Formula	C9H14O6
Molecular Weight	218.2039
SMILES	O=C([C@H]1OC(C)(C)O[C@@H]1C(OC)=O)OC
Synonyms	37031-30-4, (4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester, (+)-Dimethyl 2,3-O-isopropylidene-D-tartrate, (+)-Dimethyl-2,3-o-isopropylidene-d-tartrate, (4S,5S)-Dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, Dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, (+)-DIMETHYL 2,3-O-ISOPROPYLIDENE-D-TARTRATE, 97%, PubChem6765, AC1LELGO, Dimethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate #, SCHEMBL10266772, ZINC56780, ROZOUYVVWUTPNG-WDSKDSINSA-N, MFCD00040504, AKOS030632709, VC30485, OR315278, ZB001814, DB-013210, TC-172888, I0474, (+)-Dimethyl-2,3-O-isopropylidine-D-tartrate, Dimethyl (+)-2,3-O-Isopropylidene-D-tartrate, I14-4264, J-640441, J-800409, (+)-Dimethyl 2,3-O-isopropylidene-D-tartrate, 98%, 2-O,3-O-Isopropylidene-D-tartaric acid dimethyl ester, (+)-2,3-O-Isopropylidene-D-tartaric Acid Dimethyl Ester, 1,3-Dioxolane-4,5-dicarboxylicacid, 2,2-dimethyl-, 4,5-dimethyl ester, (4S,5S)-, i-Butyl isothiocyanate, 3-Methylthiohexyl acetate, CID688156, NSC254137, ACN-043443, (+)-Dimethyl 2,3-o-isopropylidene tartrate, Dimethyl(+)-2,3-O-Isopropylidene-D-tartrate, (4S,5S)-Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, -2,2-DIMETHYL-1,3-DIOXOLANE-4,5-DICARBOXYLICACIDDIMETHYLESTER, 1,3-Dioxolane-4,5-dicarboxylic acid, 2,2-dimethyl-, dimethyl ester, (4S,5S)-,

Complexity	246
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	218.079g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.205g/mol
Monoisotopic Mass	218.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	71.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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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