AG003PM7

22398-14-7 | 1,3-Dimethyl 2-(methoxymethylidene)propanedioate

AG003PM7

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CAS Number	22398-14-7
Catalog Number	AG003PM7(AGN-PC-0JLYUR)
Chemical Name	1,3-Dimethyl 2-(methoxymethylidene)propanedioate
EC Number	244-957-4
IUPAC Name	dimethyl 2-(methoxymethylidene)propanedioate
InChI	InChI=1S/C7H10O5/c1-10-4-5(6(8)11-2)7(9)12-3/h4H,1-3H3
InChI Key	RHFZTBSULNJWEI-UHFFFAOYSA-N
MDL Number	MFCD00038225
Molecular Formula	C7H10O5
Molecular Weight	174.1513
NSC Number	131266
SMILES	O=C(OC)/C(C(OC)=O)=C\\OC
Synonyms	Dimethyl methoxymethylenemalonate, 22398-14-7, Dimethyl 2-(methoxymethylene)malonate, 1,3-dimethyl 2-(methoxymethylidene)propanedioate, Methoxymethylenemalonic Acid Dimethyl Ester, dimethyl 2-(methoxymethylidene)propanedioate, MFCD00038225, Dimethyl methoxymethylenemalonate, 98+%, dimethyl(methoxymethylene)malonate, EINECS 244-957-4, AC1L3KOI, ACMC-1CQ9E, AC1Q5YK7, dimethylmethoxymethylenemalonate, SCHEMBL166090, Propanedioic acid, (methoxymethylene)-, dimethyl ester, Jsp004552, CTK3J4804, KS-00000VTI, dimethyl methoxymethylidenemalonate, DTXSID90176925, RHFZTBSULNJWEI-UHFFFAOYSA-N, dimethyl (methoxymethylene)malonate, ZINC1718015, dimethyl methoxymethylenepropanedioate, 1323AB, ANW-24861, NSC131266, dimethyl methoxymethylene-propanedioate, AKOS016010185, FS-4252, NE10934, NSC-131266, dimethyl(methoxymethylidene)propanedioate, dimethyl (methoxymethylidene)propanedioate, methoxymethylenmalonic acid dimethyl ester, AJ-30899, SC-62294, RT-002189, C3267, FT-0625087, M1207, ST24030366, 2-(Methoxymethylene)malonic acid dimethyl ester, W-107475, I14-57449, InChI=1/C7H10O5/c1-10-4-5(6(8)11-2)7(9)12-3/h4H,1-3H, C7H10O5, Propanedioic acid, dimethyl ester, CID90770, Dimethyl2-(methoxymethylene)malonate, AR-1I5783, C7-H10-O5, ACN-051490, Dimethyl methoxymethylenemalonate, 98% 10g, 22929-31-3,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.152g/mol
Monoisotopic Mass	174.053g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	61.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
UN Code

Certificate of Analysis

Lot Number