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3-(Cyanoacetyl)-1-methylindole

3-(Cyanoacetyl)-1-methylindole structure

CAS No:
343778-74-5
Formula:
C12H10N2O
Chemical Name:
3-(Cyanoacetyl)-1-methylindole
Synonyms:
3-(1-methylindol-3-yl)-3-oxopropanenitrile;

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3-(Cyanoacetyl)-1-methylindole Basic Attributes

Molecular Weight：

198.22100

Exact Mass：

198.079312947

DSSTox ID：

DTXSID50504205

HScode：

2933990090

Characteristics

PSA：

45.79000

XLogP3：

2.27468

Density：

1.14g/cm3

Boiling Point：

423.5ºC

Flash Point：

209.9ºC

Refractive Index：

1.602

Safety Information

Marks：

Computed Properties

Molecular Weight:198.22
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:198.079312947
Monoisotopic Mass:198.079312947
Topological Polar Surface Area:45.8
Heavy Atom Count:15
Complexity:304
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(Cyanoacetyl)-1-methylindole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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