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4-Isocyanato-1-methyl-1H-indole

4-Isocyanato-1-methyl-1H-indole structure

CAS No:
887922-92-1
Formula:
C10H8N2O
Chemical Name:
4-Isocyanato-1-methyl-1H-indole
Synonyms:
1H-Indole,4-isocyanato-1-methyl-;4-Isocyanato-1-methyl-1H-indole

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4-Isocyanato-1-methyl-1H-indole Basic Attributes

Molecular Weight：

172.18300

Exact Mass：

172.18

DSSTox ID：

DTXSID40594539

Characteristics

PSA：

34.36000

XLogP3：

2.14560

Density：

1.16g/cm3

Boiling Point：

297.3ºC

Flash Point：

133.6ºC

Refractive Index：

1.606

Computed Properties

Molecular Weight:172.18
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:172.063662883
Monoisotopic Mass:172.063662883
Topological Polar Surface Area:34.4
Heavy Atom Count:13
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Isocyanato-1-methyl-1H-indole

Basic Attributes
Characteristics
Computed Properties

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