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2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYLTHIOCYANATE

2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYLTHIOCYANATE structure

CAS No:
937602-21-6
Formula:
C10H9NO3S2
Chemical Name:
2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYLTHIOCYANATE
Synonyms:
2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYL THIOCYANATE;Thiocyanic acid, 2-[4-(methylsulfonyl)phenyl]-2-oxoethyl ester

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2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYLTHIOCYANATE Basic Attributes

Molecular Weight：

255.31

Exact Mass：

255.00238550

DSSTox ID：

DTXSID10594804

Characteristics

Density：

1.368±0.06 g/cm3

Melting Point：

147-149°C

Boiling Point：

515.3±50.0 °C(Predicted)

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:255.3
XLogP3:1.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:255.00238550
Monoisotopic Mass:255.00238550
Topological Polar Surface Area:109
Heavy Atom Count:16
Complexity:394
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-(METHYLSULFONYL)PHENYL]-2-OXOETHYLTHIOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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