AG003PL1

88754-66-9 | 2,5-Dioxahexanedioic acid dimethyl ester

AG003PL1

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CAS Number	88754-66-9
Catalog Number	AG003PL1(AGN-PC-0VNUD7)
Chemical Name	2,5-Dioxahexanedioic acid dimethyl ester
IUPAC Name	2-methoxycarbonyloxyethyl methyl carbonate
InChI	InChI=1S/C6H10O6/c1-9-5(7)11-3-4-12-6(8)10-2/h3-4H2,1-2H3
InChI Key	DOMLQXFMDFZAAL-UHFFFAOYSA-N
MDL Number	MFCD00085447
Molecular Formula	C6H10O6
Molecular Weight	178.1400
NSC Number	97193
SMILES	O=C(OC)OCCOC(OC)=O
Synonyms	88754-66-9, Dimethyl 2,5-Dioxahexanedioate, 2,5-Dioxahexanedioic Acid Dimethyl Ester, NSC97193, ethane-1,2-diyl dimethyl biscarbonate, 2-methoxycarbonyloxyethyl methyl carbonate, ACMC-209qx6, SCHEMBL47896, AC1L68S9, AC1Q44E9, CTK5G1369, DTXSID20294585, AC1Q6889, ZINC1627225, ANW-39160, MFCD00085447, NSC-97193, ethane-1,2-diyl dimethyl dicarbonate, AKOS015840251, MCULE-1925126036, CJ-26225, TR-032370, 2,5-DIOXAHEXANEDIOICACIDDIMETHYLESTER, D2455, FT-0610486, ETHYLENE GLYCOL BIS-(METHYL CARBONATE), C-55525, [({2-[(methoxycarbonyl)oxy]ethoxy}carbonyl)oxy]methane, Carbonic acid,C,C'-1,2-ethanediyl C,C'-dimethyl ester, AR-1I7394, CID263025, 90012-37-6,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.048g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.14g/mol
Monoisotopic Mass	178.048g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	71.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H227
Packing Group	Ⅲ
Precautionary statements	P210-P280-P403+P235-P501
UN Code	UN 1993

Certificate of Analysis

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