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1H-Imidazole-2-carboxylicacid,4,5-dihydro-5-oxo-

1H-Imidazole-2-carboxylicacid,4,5-dihydro-5-oxo- structure

CAS No:
861293-24-5
Formula:
C4H4N2O3
Chemical Name:
1H-Imidazole-2-carboxylicacid,4,5-dihydro-5-oxo-
Synonyms:
1H-Imidazole-2-carboxylic acid, 4,5-dihydro-5-oxo-

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1H-Imidazole-2-carboxylicacid,4,5-dihydro-5-oxo- Basic Attributes

Molecular Weight：

128.09

Exact Mass：

128.02219199

DSSTox ID：

DTXSID00628086

Characteristics

PSA：

78.76000

XLogP3：

-1.63630

Density：

1.84±0.1 g/cm3

Melting Point：

113 °C

Boiling Point：

298.6±23.0 °C(Predicted)

PKA：

-1.81±0.20

Computed Properties

Molecular Weight:128.09
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:128.02219199
Monoisotopic Mass:128.02219199
Topological Polar Surface Area:78.8
Heavy Atom Count:9
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1H-Imidazole-2-carboxylicacid,4,5-dihydro-5-oxo-

Basic Attributes
Characteristics
Computed Properties

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