Diethyl malate

CAT: 0931-T207821-02Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0931-T207821-02Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

7554-12-3

Target

Others

Related Pathways

Others

Bioactivity

Diethyl malate is a succinate ester suitable for biochemical experiments and drug synthesis research.

Smiles

O=C(OCC)CC(O)C(=O)OCC

Molecular Formula

C8H14O5

Molecular Weight

190.19

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Diethyl malate

Diethyl malate is a malate ester obtained by the formal condensation of the two carboxy groups of malic acid with two molecules of ethanol respectively. It has a role as a metabolite.

CAS Number	7554-12-3
PubChem CID	24197
IUPAC Name	diethyl 2-hydroxybutanedioate
Molecular Formula	C8H14O5
Molecular Weight	190.19
XLogP	0.1
Topological Polar Surface Area	72.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Heavy Atom Count	13
Formal Charge	0
Complexity	177

SMILES

CCOC(=O)CC(C(=O)OCC)O

InChI

InChI=1S/C8H14O5/c1-3-12-7(10)5-6(9)8(11)13-4-2/h6,9H,3-5H2,1-2H3

InChIKey

VKNUORWMCINMRB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7554-12-3

CID: 24197

Formula: C8H14O5

MW: 190.19

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	190.19
XLogP3	0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	190.08412354
Monoisotopic Mass	190.08412354
Topological Polar Surface Area	72.8 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	177
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T5616	Diethyl malonate
T202916-01	Phenampromide malate
T0374-01	Sunitinib Malate
T0225-01	Pizotifen Malate
TYD-01187-01	Calcium malate
T71111-01	Famitinib malate
T0112L2-01	Diltiazem malate
T20200-01	Citrulline malate
T2317-01	Almotriptan Malate
T7569-01	Clebopride malate

Alternative Products

Catalog	Name
GTR19257624	Diethyl malate
446844-01	Diethyl L- (-) -Malate
D23500-01	Diethyl DL-malate
TRC-D444415-25G	Diethyl D-Malate
abx183988-01	Diethyl L-malate
sc-294321	Diethyl D- (+) -Malate
TRC-D444510-25G	Diethyl L-(-)-Malate
B2243-S	Almotriptan Malate
A8255-100	Sunitinib malate
A2589-50	Vicriviroc Malate

Diethyl malate

Chemical Information

Related Products

Alternative Products

Popular Products