Diethyl ethoxymethylenemalonate

CAT: 0127-OR1012869-01Size: 500 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1012869-01Size:500 g

Selected

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

Quick Request Actions

CAS Number

87-13-8

MDL Number

MFCD00009148

Purity

99%

Smiles

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

Chemical Information

Diethyl (ethoxymethylene)malonate

CAS Number	87-13-8
PubChem CID	6871
IUPAC Name	diethyl 2-(ethoxymethylidene)propanedioate
Molecular Formula	C10H16O5
Molecular Weight	216.23
XLogP	1.5
Topological Polar Surface Area	61.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Heavy Atom Count	15
Formal Charge	0
Complexity	224

SMILES

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

InChI

InChI=1S/C10H16O5/c1-4-13-7-8(9(11)14-5-2)10(12)15-6-3/h7H,4-6H2,1-3H3

InChIKey

LTMHNWPUDSTBKD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 87-13-8

CID: 6871

Formula: C10H16O5

MW: 216.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	216.23
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Exact Mass	216.09977361
Monoisotopic Mass	216.09977361
Topological Polar Surface Area	61.8 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	224
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1078506-01	Diethyl Acetonylmalonate
OR1076845-01	Diethyl Tetradecanedioate
OR1030621-01	Diethyl Isobutylmalonate
BUP19722	Diethyl fumarate
OR1003470-01	Diethyl Cyclobutylidenemalonate
OR1012879	Diethyl succinate
BUP14825	Diethyl phosphate
OR1043911-01	Diethyl Azamalonate
OR74771-01	Diethyl allylmalonate
OR939685-01	Diethyl itaconate

Catalog	Name
abx188681	Diethyl Ethoxymethylenemalonate
1001B 00100	Diethyl Ethoxymethylenemalonate 98% For Synthesis
TRC-P359432-10MG	Diethyl phosphate-d10 (diethyl-d10)
D24360-01	Diethyl phosphonacetaldehyde diethyl acetal 98%
B9076	Butyronitrile Diethyl Malonate (Diethyl-3-cyanopropylmalonate)
070975	Diethyl Carbamyl Chloride (Diethyl Carbamoyl Chloride)
sc-202574A	Diethyl Pyrocarbonate
C6538-500	Diethyl fumarate
BA8017-25	Diethyl-pythiDC
QAA30097-01	Diethyl acetoxyethylphosphonate