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diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate structure

CAS No:
36422-59-0
Formula:
C20H25NO4
Chemical Name:
diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Synonyms:
diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate;CHEMBL1977154;36422-59-0;SR-01000321366;2,6-Dimethyl-4-p-tolyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid diethyl ester;NSC657195;CBMicro_029986;Oprea1_179674;Oprea1_698653;SCHEMBL3032293;ZINC229015;BDBM50073959;CCG-20383;STK861992;AKOS000573916;MCULE-4734974865;NSC-657195;3,5-diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate;NCI60_019816;BIM-0030005.P001;EU-0011479;SR-01000321366-1;SR-01000321366-2;Z90442211;3,5-dicarboethoxy-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine;Diethyl 2,6-dimethyl-4-p-tolyl-1,4-dihydropyridine-3,5-dicarboxylate;1,4-Dihydro-2,6-dimethyl-4-(4-methylphenyl)pyridine-3,5-dicarboxylic acid diethyl ester

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diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Basic Attributes

Molecular Weight：

343.4 g/mol

Exact Mass：

343.17835828 g/mol

NSC Number：

657195

Characteristics

PSA：

64.6 Å²

XLogP3：

3.6848

Melting Point：

140 - 143 °C (ethanol)

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:343.4
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:343.17835828
Monoisotopic Mass:343.17835828
Topological Polar Surface Area:64.6
Heavy Atom Count:25
Complexity:543
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of diethyl 2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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