Dimethyl methylsuccinate - CAS 1604-11-1

Name: Dimethyl methylsuccinate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB011633
Product Name:	Dimethyl methylsuccinate
CAS:	1604-11-1
Synonyms:	dimethyl 2-methylbutanedioate

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	dimethyl 2-methylbutanedioate
Description:	Dimethyl methylsuccinate (CAS# 1604-11-1) is a useful research chemical.
Molecular Weight:	160.17
Molecular Formula:	C7H12O4
Canonical SMILES:	CC(CC(=O)OC)C(=O)OC
InChI:	InChI=1S/C7H12O4/c1-5(7(9)11-3)4-6(8)10-2/h5H,4H2,1-3H3
InChI Key:	NFOQJNGQQXICBY-UHFFFAOYSA-N
Boiling Point:	196 °C at 760 mmHg
Density:	1.076 g/mL at 25 °C (lit.)
Appearance:	Liquid
MDL:	MFCD00008449
LogP:	0.35860

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Publication Number	Title	Priority Date
WO-2021119389-A1	Compositions and methods for the degradation of waste polypropylene	20191211
CN-112824421-A	Chiral phosphine-phosphoramidite ligand and preparation method and application thereof	20191121
EP-3740309-A1	Process for preparation of a specific catalyst for selective hydrogenation and hydrogenation of aromatic compounds by kneading	20180115
US-2020338531-A1	Process for preparation of a specific catalyst for selective hydrogenation and hydrogenation of aromatic compounds by kneading	20180115
EP-3652245-A1	Additive mixtures for plastics, laser-markable polymer compositions containing same, and use thereof	20170714

PMID	Publication Date	Title	Journal
18031047	20071220	Stereocomplementary bioreduction of alpha,beta-unsaturated dicarboxylic acids and dimethyl esters using enoate reductases: enzyme- and substrate-based stereocontrol	Organic letters
11942683	20020201	A new approach for asymmetric synthesis of (R)-3-methylpyrrolidine alkaloids from (S)-malic acid	Natural product letters
11261665	20010202	Chiral bicyclic phosphoramidites--a new class of ligands for asymmetric catalysis	Chemistry (Weinheim an der Bergstrasse, Germany)

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	160.07355886
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	160.07355886
Rotatable Bond Count:	5
Topological Polar Surface Area:	52.6
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4