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4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID

4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID structure

CAS No:
82228-58-8
Formula:
C11H9N3O4
Chemical Name:
4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID
Synonyms:
4-Nitro-1-(phenylmethyl)-1H-imidazole-5-carboxylic acid;1-BENZYL-4-NITRO-1H-IMIDAZOLE-5-CARBOXYLIC ACID;3-Benzyl-5-nitro-3H-imidazole-4-carboxylic acid;1H-Imidazole-5-carboxylicacid, 4-nitro-1-(phenylmethyl)-;4-Nitro-1-(phenylmethyl)-1H-imidazole-5-carboxylicacid;CTK3E7778;DTXSID20565328;ZINC16677906;AKOS015961271;AB24971

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4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID Basic Attributes

Molecular Weight：

247.20700

Exact Mass：

247.05900

DSSTox ID：

DTXSID20565328

Characteristics

PSA：

100.94000

XLogP3：

2.06100

Density：

1.47g/cm3

Boiling Point：

522.165ºC at 760 mmHg

Flash Point：

269.596ºC

Refractive Index：

1.666

Computed Properties

Molecular Weight:247.21
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:247.05930578
Monoisotopic Mass:247.05930578
Topological Polar Surface Area:101
Heavy Atom Count:18
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID

Basic Attributes
Characteristics
Computed Properties

4-NITRO-1-(PHENYLMETHYL)-1H-IMIDAZOLE-5-CARBOXYLICACID

SDS

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