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3,5-Bis(methylthio)-4-isothiazolecarboxamide

3,5-Bis(methylthio)-4-isothiazolecarboxamide structure

CAS No:
4886-14-0
Formula:
C6H8N2OS3
Chemical Name:
3,5-Bis(methylthio)-4-isothiazolecarboxamide
Synonyms:
4-Isothiazolecarboxamide,3,5-bis(methylthio)-;3,5-Bis(methylthio)-4-isothiazolecarboxamide;NSC 379558;3,5-Di(methylthio)isothiazole-4-carboxamide;3,5-Bis(methylsulfanyl)-1,2-thiazole-4-carboxamide

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3,5-Bis(methylthio)-4-isothiazolecarboxamide Basic Attributes

Molecular Weight：

220.33600

Exact Mass：

220.34

NSC Number：

379558

DSSTox ID：

DTXSID60321667

HScode：

2934999090

Characteristics

PSA：

134.82000

XLogP3：

2.38610

Density：

1.46g/cm3

Melting Point：

208-210 °C

Boiling Point：

254.5ºC at 760mmHg

Flash Point：

107.7ºC

Refractive Index：

1.672

Computed Properties

Molecular Weight:220.3
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:219.97987640
Monoisotopic Mass:219.97987640
Topological Polar Surface Area:135
Heavy Atom Count:12
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,5-Bis(methylthio)-4-isothiazolecarboxamide

Basic Attributes
Characteristics
Computed Properties

3,5-Bis(methylthio)-4-isothiazolecarboxamide

SDS

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