DIETHYL 2-ANILINOMALONATE CAS NO.6414-58-0

Hunan chemfish Pharmaceutical co.,Ltd.located in Lugu High-tech industral park ,Hunan province . with its own R&D center and more than 10000㎡manufacture plant . Chemfish owns 40 reactors from 1000L to 8000L. With complete auxiliary equipment as: Fractionating columns, Boilers, Refrigeration unit, sewage treatment. we provide from a test to large-scale production for customers,and have analytical instruments such as GC,HPLC ,NMR and so on.

We mainly provide :
Alkylated aniline series
Salicylic acid
Sulphonic acid series
Phenyltrichlorosilane
Diphenyldichlorosilane
Other fine chemical products

The annual production up to 2000tons .Products are widely used in adhesives, dye, medicine ,resin and ceramic coating etc. Industry.

We sincerely welcome customs synthesis !
Process Capability : 2000/tons per year
After-sale Service : Our service There is no any quality claim after sale, how do you make it 1. Our staff are all experienced and with chemistry related major background, they will study and confirm what EXACT PRODUCT YOU NEED! 2. Free sample or Pre-shipment sample are available for NEW Project of NEW customers before commercial purchasing. 3. Third Party Inspection like SGS can be arranged according to requirement. 4. On-Spot QC in our APPROVED associated production bases with necessary certification like GMP, ISO etc. 5. Routine PLANT AUDIT by techniques from us or customers. How can you guarantee the quality we receive is same as the sample or specification 1. Third Party like CIQ, SGS inspection before shipment upon request. 2. In Case of PSS we will hold the cargo until approval from custom

Identification and Related Records

【Name】

Propanedioic acid,2-(phenylamino)-, 1,3-diethyl ester

【Iupac name】

diethyl 2-anilinopropanedioate

【CAS Registry number】

6414-58-0

【Synonyms】

Malonicacid, anilino-, diethyl ester (6CI,7CI,8CI)
Propanedioic acid, (phenylamino)-,diethyl ester (9CI)
(Phenylamino)malonic acid diethyl ester
Diethyl2-(phenylamino)malonate
Diethyl anilinomalonate
NSC 174010

【Molecular Formula】

C13H17 N O4 (Products with the same molecular formula)

【Molecular Weight】

251.27838

【Inchi】

InChI=1/C13H17NO4/c1-3-17-12(15)11(13(16)18-4-2)14-10-8-6-5-7-9-10/h5-9,11,14H,3-4H2,1-2H3

【Canonical SMILES】

CCOC(=O)C(C(=O)OCC)NC1=CC=CC=C1

【MOL File】
6414-58-0.mol

Chemical and Physical Properties

【Density】

1.167g/cm³

【Boiling Point】

340.6°C at 760 mmHg

【Refractive Index】

1.536

【Flash Point】

159.8°C

【Computed Properties】

Molecular Weight:251.27838 [g/mol]
Molecular Formula:C₁₃H₁₇NO₄
XLogP3-AA:2.7
H-Bond Donor:1
H-Bond Acceptor:5
Rotatable Bond Count:8
Exact Mass:251.115758
MonoIsotopic Mass:251.115758
Topological Polar Surface Area:64.6
Heavy Atom Count:18
Formal Charge:0
Complexity:256
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
Feature 3D Acceptor Count:2
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:8
Conformer Sampling RMSD:0.8
CID Conformer Count:43

Safety and Handling

【HazardClass】

IRRITANT