Name: Name:3,4-Dimethyl-1h-pyrrole-2-carboxylic acid ethyl ester
Brand: AABLOCKS
SKU: AA006BZO
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA006BZO

Chemical Name: 3,4-Dimethyl-1h-pyrrole-2-carboxylic acid ethyl ester

CAS Number: 938-75-0

Molecular Formula: C9H13NO2

Molecular Weight: 167.2050

MDL Number: MFCD00030365

SMILES: CCOC(=O)c1[nH]cc(c1C)C

Properties

BP: 274.3±35.0°C at 760 mmHg

Form: Solid

MP: 105-108℃

Storage: Keep in dry area;Room Temperature;

Complexity: 170

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2

Literature fold

Title: Ethyl 3,4-dimethyl-1H-pyrrole-2-carboxyl-ate.

Journal: Acta crystallographica. Section E, Structure reports online20100901

Title: Ethyl 5-formyl-3,4-dimethyl-1H-pyrrole-2-carboxyl-ate.

Journal: Acta crystallographica. Section E, Structure reports online20090701

938-75-0 | 3,4-Dimethyl-1h-pyrrole-2-carboxylic acid ethyl ester