4-nitrophenyl phosphate (C6H6NO6P)

4-nitrophenyl phosphate (C6H6NO6P; CAS 330-13-2) is a practical retrosynthesis target. 4-nitrophenyl phosphate presents a C6 framework, aromatic rings, a nitro group. Open AI route search in one click below.

Target: 4-nitrophenyl phosphate
CAS: 330-13-2
Formula: C6H6NO6P
Approx. MW: 219.09
SMILES: O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1
PubChem CID: 378
Approx. carbons: C6

4-nitrophenyl phosphate structure

Properties

IUPAC name: (4-nitrophenyl) dihydrogen phosphate
Common names: 4-nitrophenyl phosphate; 330-13-2; 4-Nitrophenyl dihydrogen phosphate; p-nitrophenyl phosphate; Nitrophenylphosphate; Phosphoric acid, mono(4-nitrophenyl) ester; p-Nitrophenyl dihydrogen phosphate; (4-nitrophenyl) dihydrogen phosphate; p-Nitrophenol phosphate; 4-nitrophenylphosphate
Molecular weight: 219.09
Exact mass: 218.99
InChIKey: XZKIHKMTEMTJQX-UHFFFAOYSA-N

View on PubChem

4-nitrophenyl phosphate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-nitrophenyl phosphate?

4-nitrophenyl phosphate has molecular formula C6H6NO6P. Molecular weight about 219.09 g·mol⁻¹.

What is the CAS number of 4-nitrophenyl phosphate?

The CAS Registry Number for 4-nitrophenyl phosphate is 330-13-2.

Run AI retrosynthesis for 4-nitrophenyl phosphate Target catalog AI tools overview

One click loads 4-nitrophenyl phosphate into ChemicalHelper Reaction for route exploration.

Related targets

Similar compounds

1-Bromo-2-nitrobenzene 1-Bromo-3-nitrobenzene 1-Bromo-4-nitrobenzene 1-Chloro-3-nitrobenzene 1-Iodo-3-nitrobenzene 1-Iodo-4-nitrobenzene

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References & tools

ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.