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Ammonium 4-nitrobenzoate dihydrate

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Name

Ammonium 4-nitrobenzoate dihydrate

EINECS N/A
CAS No. 19416-70-7 Density N/A
PSA 86.36000 LogP 2.14010
Solubility N/A Melting Point N/A
Formula C7H8N2O4.2(H2O) Boiling Point 411.3oC at 760 mmHg
Molecular Weight 184.152 Flash Point 202.6oC
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 19416-70-7 (Ammonium 4-nitrobenzoate dihydrate) Hazard Symbols N/A
Synonyms

Benzoicacid, 4-nitro-, ammonium salt (9CI);Benzoic acid, p-nitro-, ammonium salt(8CI);Ammonium 4-nitrobenzoate;Ammonium p-nitrobenzoate;

 

Ammonium 4-nitrobenzoate dihydrate Specification

The Ammonium 4-nitrobenzoate dihydrate is an organic compound with the formula C7H8N2O4.2(H2O). The systematic name of this chemical is benzoic acid, 4-nitro-, ammonium salt, hydrate (1:2). With the CAS registry number 19416-70-7, it is also named as Ammonium 4-nitrobenzoate hydrate (1:1:2). The product's classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1C(=O)[O-])[N+](=O)[O-].[NH4+].O.O
(2)InChI: InChI=1/C7H5NO4.H3N.2H2O/c9-7(10)5-1-3-6(4-2-5)8(11)12;;;/h1-4H,(H,9,10);1H3;2*1H2
(3)InChIKey: FRAODYKUTZKECF-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H5NO4.H3N.2H2O/c9-7(10)5-1-3-6(4-2-5)8(11)12;;;/h1-4H,(H,9,10);1H3;2*1H2
(5)Std. InChIKey: FRAODYKUTZKECF-UHFFFAOYSA-N

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