Sodium fumarate dibasic - CAS 17013-01-3

Catalog:	BB012617
Product Name:	Sodium fumarate dibasic
CAS:	17013-01-3
Synonyms:	disodium;(E)-but-2-enedioate

Technical Data

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Computed Properties

IUPAC Name:	disodium;(E)-but-2-enedioate
Description:	Disodium Fumarate can be used to reduce or prevent dilution of target protein during recovery flush after filtration.
Molecular Weight:	160.04
Molecular Formula:	C4H2Na2O4
Canonical SMILES:	C(=CC(=O)[O-])C(=O)[O-].[Na+].[Na+]
InChI:	InChI=1S/C4H4O4.2Na/c5-3(6)1-2-4(7)8;;/h1-2H,(H,5,6)(H,7,8);;/q;2*+1/p-2/b2-1+;;
InChI Key:	MSJMDZAOKORVFC-SEPHDYHBSA-L
Boiling Point:	355.5 °C at 760 mmHg
Purity:	98 %
Appearance:	White crystalline powder
MDL:	MFCD00064567
LogP:	-2.95760

Publication Number	Title	Priority Date
US-2015126676-A1	Ester-Functional Silanes And The Preparation And Use Thereof; And Use Of Iminium Compounds As Phase Transfer Catalysts	20111202
US-2003191316-A1	Ester derivatives	20000711
US-2005065211-A1	Ester derivatives	20000711
US-6846835-B2	Ester derivatives	20000711
US-7192969-B2	Ester derivatives	20000711

PMID	Publication Date	Title	Journal
23707484	20130801	Fumaric acid attenuates the eotaxin-1 expression in TNF-α-stimulated fibroblasts by suppressing p38 MAPK-dependent NF-κB signaling	Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association
22944427	20121106	Preparation of pH- and ionic-strength responsive biodegradable fumaric acid crosslinked carboxymethyl cellulose	Carbohydrate polymers
22717128	20121101	Effect of disodium fumarate on microbial abundance, ruminal fermentation and methane emission in goats under different forage: concentrate ratios	Animal : an international journal of animal bioscience
22924969	20121001	Composition of sugars, organic acids, and total phenolics in 25 wild or cultivated berry species	Journal of food science
22814110	20120901	Metabolic engineering of Rhizopus oryzae: effects of overexpressing pyc and pepc genes on fumaric acid biosynthesis from glucose	Metabolic engineering

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	159.97484710
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	159.97484710
Rotatable Bond Count:	0
Topological Polar Surface Area:	80.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0