Phosphoric acid, mono(4-nitrophenyl) ester, compd. with cyclohexanamine (1:2)
Basic information
- CAS
52483-84-8- Standard SMILES
NC1CCCCC1.NC1CCCCC1.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1- InChIKey
KXNNUYCXODNFBD-UHFFFAOYSA-N- Molecular formula
- C18H32N3O6P
- Average molar mass
- 417.4 g/mol
- Monoisotopic mass
- 417.20287275
Names & identifiers
- Preferred name
- Phosphoric acid, mono(4-nitrophenyl) ester, compd. with cyclohexanamine (1:2)
- IUPAC
- bis(cyclohexanamine);(4-nitrophenyl) dihydrogen phosphate
- English name
- 4-Nitrophenyl phosphate bis(cyclohexylammonium) salt
- Molecular formula
- C18H32N3O6P
- Molecular weight
- 417.44
Names & synonyms
52483-84-8EINECS 257-949-0DTXSID20886005Phosphoric acid, mono(4-nitrophenyl) ester, cyclohexanamine salt (1:2)RefChem:173776DTXCID7010253554-Nitrophenyl phosphate, bis(cyclohexylammonium) saltcyclohexanamine;(4-nitrophenyl) dihydrogen phosphateSCHEMBL9683462C18H32N3O6PKXNNUYCXODNFBD-UHFFFAOYSA-NMFCD00013173
Show more names
PNP-PHOS 2 CHXCyclohexanaminium 4-nitrophenyl phosphateP-NITROPHENYL PHOSPHATE DICYCLOHEXYLAMINE SALTP-NITROPHENYL PHOSPHATE*DI(CYCLOHEXYLAMM ONIUM)4-Nitrophenyl phosphate di(cyclohexylamine) salt.4-NITROPHENYL PHOSPHATE BIS(CYCLOHEXYLAMINE) SALT4-nitrophenoxyphosphate dicyclohexyl ammonium saltP-NITROPHENYL PHOSPHATE DI(CYCLOHEXYLAMMONIUM) SALT
AKOS015916609AKOS016015770EN137414-Nitrophenyl phosphate cyclohexylammoniumNS000895974-Nitrophenyl phosphate bis(cyclohexylammonium)F87999N-4700
Database identifiers
- CAS
52483-84-8- PubChem CID
- 104209
- DTXSID
DTXSID20886005- EC Number
- 257-949-0
Properties
Computed structural properties
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Melting point
- 199 · 199-200°C
- storage temp.
- -20 °C · -20°C
- form
- powder
- Water Solubility
- 10 mg/mL, · water: 10mg/mL, clear, colorless to faintly yellow
- BRN
- 6553276 · 6553276
- CAS DataBase Reference
- 52483 · 52483-84-8(CAS DataBase Reference)
- EPA Substance Registry System
- Phosphoric acid, mono(4-nitrophenyl) ester, compd. with cyclohexanamine (1:2) (52483-84-8)
- UNSPSC Code
- 12352204 · 12352204
- NACRES
- 83 · NA.83
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 8 · 8-10-21
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 8-10-21
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2940000080
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphoric acid, mono(4-nitrophenyl) ester, compd. with cyclohexanamine (1:2): INACTIVE
Applications
Uses4-Nitrophenyl phosphate bis(cyclohexylammonium) salt has been used as a component in the colorimetric reagent for abscisic acid (ABA) assay.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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