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1H-Benzimidazole-1-carbonitrile(9CI)

1H-Benzimidazole-1-carbonitrile(9CI) structure

CAS No:
31892-41-8
Formula:
C8H5N3
Chemical Name:
1H-Benzimidazole-1-carbonitrile(9CI)
Synonyms:
1H-Benzimidazole-1-carbonitrile(9CI);N-Cyanobenzimidazole;1-Cyanobenzimidazole 96%;1-Cyanobenzimidazole;1H-Benzimidazole-1-carbonitrile

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1H-Benzimidazole-1-carbonitrile(9CI) Basic Attributes

Molecular Weight：

143.15

Exact Mass：

143.048347172

DSSTox ID：

DTXSID70578044

HScode：

2933990090

Characteristics

PSA：

41.61000

XLogP3：

1.36548

Density：

1.22±0.1 g/cm3

Melting Point：

98-106°C

Boiling Point：

303.6±25.0 °C(Predicted)

PKA：

0.69±0.10

Safety Information

Transport codes：

UN 2811 6.1 / PGIII

wgk germany：

hazard class code：

25-37/38-41

safety instructions：

26-39-45

Marks：

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P362, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

N-cyanobenzimidazole

Computed Properties

Molecular Weight:143.15
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Exact Mass:143.048347172
Monoisotopic Mass:143.048347172
Topological Polar Surface Area:41.6
Heavy Atom Count:11
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: calcium bromide; nitrous acid formula; calcium carbonate compound formula; bioglutide; sulfur trioxide; barium sulfate formula

Guide of 1H-Benzimidazole-1-carbonitrile(9CI)

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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