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ethyl 5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylate

ethyl 5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylate structure

CAS No:
113858-90-5
Formula:
C10H10N2O2S
Chemical Name:
ethyl 5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylate
Synonyms:
ethyl 5-cyano-2-methyl-6-thioxo-1,6-dihydropyridine-3-carboxylate; HMS566O13; 3-Pyridinecarboxylicacid,5-cyano-1,6-dihydro-2-methyl-6-thioxo-,ethyl ester; ethyl 5-cyano-6-mercapto-2-methylnicotinate;

Description

5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylic acid ethyl ester is a member of pyridines and an aromatic carboxylic acid.

ethyl 5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylate Basic Attributes

Molecular Weight：

222.26400

Exact Mass：

222.04629874 g/mol

DSSTox ID：

DTXSID90352227

HScode：

2933399090

Characteristics

PSA：

101.78000

XLogP3：

1.72708

Density：

1.29g/cm3

Boiling Point：

302.8ºC

Flash Point：

136.9ºC

Water Solubility：

33.1 [ug/mL]

Vapor Pressure：

0.000653mmHg at 25°C

Computed Properties

Molecular Weight:222.27
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:222.04629874
Monoisotopic Mass:222.04629874
Topological Polar Surface Area:94.2
Heavy Atom Count:15
Complexity:426
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 5-cyano-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylate

Description
Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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