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METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE

METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE structure

CAS No:
175202-48-9
Formula:
C8H7NO2S2
Chemical Name:
METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE
Synonyms:
Methyl 4-Cyano-5-(methylthio)thiophene-2-carboxylate;4-CYANO-5-METHYLSULFANYLTHIOPHENE-2-CARBOXYLIC ACID METHYL ESTER;methyl 4-cyano-5-(methylsulfanyl)thiophene-2-carboxylate;MFCD00173757;methyl 4-cyano-5-methylsulfanylthiophene-2-carboxylate;2-Thiophenecarboxylicacid, 4-cyano-5-(methylthio)-, methyl ester;4-Cyano-5-(methylthio)thiophene-2-carboxylic acid methyl ester;ACMC-20akgh;methyl 4-cyano-5-methylthiothiophene-2-carboxylate;SCHEMBL6928589
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE Basic Attributes

Molecular Weight：

213.28

Exact Mass：

212.99200

DSSTox ID：

DTXSID50594904

Characteristics

PSA：

104

XLogP3：

2.12828

Density：

1.36±0.1 g/cm3(Predicted)

Melting Point：

117-119℃

Boiling Point：

359.8±42.0 °C(Predicted)

Flash Point：

171.4ºC

Refractive Index：

1.596

Vapor Pressure：

2.32E-05mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN3439

Computed Properties

Molecular Weight:213.3
XLogP3:2.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:212.99182081
Monoisotopic Mass:212.99182081
Topological Polar Surface Area:104
Heavy Atom Count:13
Complexity:248
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
Learn More Other Chemicals

METHYL 4-CYANO-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE

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