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ethyl(3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate

ethyl(3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate structure

CAS No:
135387-64-3
Formula:
C8H11N3O4
Chemical Name:
ethyl(3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate
Synonyms:
ethyl (3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate;1H-Pyrazole-3-acetic acid, 5-methyl-4-nitro-, ethyl ester

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ethyl(3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate Basic Attributes

Molecular Weight：

213.19

Exact Mass：

213.07495584

Characteristics

Density：

1.345±0.06 g/cm3

Melting Point：

133-134 °C

Boiling Point：

371.0±37.0 °C(Predicted)

PKA：

9.63±0.50

Computed Properties

Molecular Weight:213.19
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:213.07495584
Monoisotopic Mass:213.07495584
Topological Polar Surface Area:101
Heavy Atom Count:15
Complexity:253
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl(3-methyl-4-nitro-1{H}-pyrazol-5-yl)acetate

Basic Attributes
Characteristics
Computed Properties

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