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2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one

2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one structure

CAS No:
79871-76-4
Formula:
C9H11N5O
Chemical Name:
2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one
Synonyms:
2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one;4(3H)-Pyrimidinone, 2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-methyl-

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2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one Basic Attributes

Molecular Weight：

205.22

Exact Mass：

205.096

Characteristics

PSA：

89.59000

XLogP3：

0.73580

Density：

1.49±0.1 g/cm3

Melting Point：

215-217 °C(Solv: ethanol (64-17-5))

Boiling Point：

481.7±37.0 °C(Predicted)

PKA：

7.29±0.50

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:205.22
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:205.09635999
Monoisotopic Mass:205.09635999
Topological Polar Surface Area:85.3
Heavy Atom Count:15
Complexity:348
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4(3H)-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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