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3-amino-5-methyl-1H-pyrazole-4-carbonitrile

3-amino-5-methyl-1H-pyrazole-4-carbonitrile structure

CAS No:
5453-07-6
Formula:
C5H6N4
Chemical Name:
3-amino-5-methyl-1H-pyrazole-4-carbonitrile
Synonyms:
NSC 19055;5-Amino-4-cyano-3-methylpyrazole;5-Amino-4-cyano-3-methyl-1H-pyrazole;5-Amino-3-methylpyrazole-4-carbonitrile;3-Amino-5-methylpyrazole-4-carbonitrile;3-amino-5-methyl-1H-pyrazole-4-carbonitrile;3-azanyl-5-methyl-1H-pyrazole-4-carbonitrile

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3-amino-5-methyl-1H-pyrazole-4-carbonitrile Basic Attributes

Molecular Weight：

122.13

Exact Mass：

122.059242

NSC Number：

19055

DSSTox ID：

DTXSID10202937

HScode：

2933199090

Characteristics

PSA：

78.5

XLogP3：

1.12

Density：

1.3±0.1 g/cm3

Melting Point：

162℃

Boiling Point：

429.4±45.0 °C at 760 mmHg

Flash Point：

213.5±28.7 °C

Refractive Index：

1.596

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302+H312+H332

GHS Classification：

|Warning|H302+H312+H332 (98.9%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 91 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:122.13
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:122.059246208
Monoisotopic Mass:122.059246208
Topological Polar Surface Area:78.5
Heavy Atom Count:9
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: etoricoxib; tert butanol; cupric oxide formula; dimethyl terephthalate drug; hydroxide anion; ammonium sulfide

Guide of 3-amino-5-methyl-1H-pyrazole-4-carbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-amino-5-methyl-1H-pyrazole-4-carbonitrile

SDS

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