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4-Amino-5-cyanoimidazole

4-Amino-5-cyanoimidazole structure

CAS No:
5098-11-3
Formula:
C4H4N4
Chemical Name:
4-Amino-5-cyanoimidazole
Synonyms:
1H-Imidazole-4-carbonitrile,5-amino-;Imidazole-4-carbonitrile,5-amino-;Imidazole-4(or 5)-carbonitrile,5(or 4)-amino-;5-Amino-1H-imidazole-4-carbonitrile;4-Aminoimidazole-5-carbonitrile;4-Amino-1H-imidazole-5-carbonitrile;4-Amino-5-cyanoimidazole;5-Amino-4-cyanoimidazole;5-Cyano-4-aminoimidazole;5-Amino-4-imidazolecarbonitrile;NSC 139091
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

Off-White to Pale Yellow Solid

4-Amino-5-cyanoimidazole Basic Attributes

Molecular Weight：

108.1

Exact Mass：

108.10

EC Number：

225-816-6

NSC Number：

139091

DSSTox ID：

DTXSID90198980

HScode：

2933290090

Characteristics

PSA：

78.5

XLogP3：

0.3

Appearance：

Off-White to Pale Yellow Solid

Density：

1.42 g/cm3

Melting Point：

128-129 °C (decomp) @ Solvent: Water

Boiling Point：

557.7ºC at 760 mmHg

Flash Point：

291.1ºC

Refractive Index：

1.621

Storage Conditions：

Refrigerator

Safety Information

Hazard category：

6.1

Transport codes：

3439

wgk germany：

hazard class code：

23/24/25-41-22-37/38

safety instructions：

22-36/37/39-45-39-26

Marks：

Precautionary statement(s)：

P280-P305 + P351 + P338

Hazard Statements：

H302-H318

GHS Classification：

|Danger|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:108.10
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:108.043596145
Monoisotopic Mass:108.043596145
Topological Polar Surface Area:78.5
Heavy Atom Count:8
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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HANGZHOU LEAP CHEM CO., LTD. Contact Supplier

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