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ethyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate

ethyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate structure

CAS No:
100507-48-0
Formula:
C18H18F2N2O3
Chemical Name:
ethyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate
Synonyms:
3-Pyridinecarboxylic acid,1,4-dihydro-5-cyano-4-(2-(difluoromethoxy)phenyl)-2,6-dimethyl-,ethyl ester;

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ethyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Basic Attributes

Molecular Weight：

348.34400

Exact Mass：

348.12854876

Characteristics

PSA：

71.35000

XLogP3：

3.93828

Density：

1.26g/cm3

Boiling Point：

449.7ºC

Flash Point：

225.8ºC

Refractive Index：

1.541

Vapor Pressure：

2.79E-08mmHg at 25°C

Computed Properties

Molecular Weight:348.3
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:348.12854876
Monoisotopic Mass:348.12854876
Topological Polar Surface Area:71.4
Heavy Atom Count:25
Complexity:634
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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