Products for Research Use Only
RegisterLogin

Diethyl Ethylphenylmalonate

CAT: 0572-TRC-D444455-10GSize: 10 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-D444455-10GSize:10 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
76-67-5
Synonyms
Diethyl 2-ethyl-2-phenylmalonate; NSC 5631; Ethylphenylpropanedioic Acid Diethyl Ester
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
CCOC(=O)C(CC)(C(=O)OCC)c1ccccc1
Molecular Formula
C15H20O4
Molecular Weight
264.32
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Diethyl ethylphenylmalonate
CAS Number76-67-5
PubChem CID66450
IUPAC Namediethyl 2-ethyl-2-phenylpropanedioate
Molecular FormulaC15H20O4
Molecular Weight264.32
XLogP2.8
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count19
Formal Charge0
Complexity287
SMILES
CCC(C1=CC=CC=C1)(C(=O)OCC)C(=O)OCC
InChI
InChI=1S/C15H20O4/c1-4-15(13(16)18-5-2,14(17)19-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3
InChIKey
PKRVDBARWFJWEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diethyl ethylphenylmalonate
CAS: 76-67-5
CID: 66450
Formula: C15H20O4
MW: 264.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight264.32
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass264.13615911
Monoisotopic Mass264.13615911
Topological Polar Surface Area52.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity287
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-P359432-10MGDiethyl phosphate-d10 (diethyl-d10)
TRC-D473613-100MGDiethyl Methylphenylmalonate
TRC-D444130-1GDiethyl Cromoglycate
TRC-D443753-2.5GDiethyl Isopropylmalonate
TRC-D444220-500MGDiethyl Difluoromethanephosphonate
TRC-D444130-250MGDiethyl Cromoglycate
TRC-D444770-100GDiethyl Phthalate
TRC-D444430-25GDiethyl Methylmalonate
TRC-D444535-5GDiethyl Maleate
TRC-D445000-100GDiethyl Suberate

Alternative Products

CatalogName
163802Diethyl Ethylphenylmalonate
D24360-01Diethyl phosphonacetaldehyde diethyl acetal 98%
B9076Butyronitrile Diethyl Malonate (Diethyl-3-cyanopropylmalonate)
070975Diethyl Carbamyl Chloride (Diethyl Carbamoyl Chloride)
sc-202574ADiethyl Pyrocarbonate
C6538-500Diethyl fumarate
BA8017-25Diethyl-pythiDC
QAA30097-01Diethyl acetoxyethylphosphonate
FD61056-01Diethyl Chlorothiophosphate
FD21801-01Diethyl phthalate

Popular Products