Basic information
- Standard SMILES
O=C(O)c1ccccc1OP(=O)(O)O- InChIKey
FFKUDWZICMJVPA-UHFFFAOYSA-N- Molecular formula
- C7H7O6P
- Average molar mass
- 218.1 g/mol
- Monoisotopic mass
- 217.99802494
Names & identifiers
- Preferred name
- Fosfosal
- IUPAC
- 2-phosphonooxybenzoic acid
- English name
- 2-Carboxyphenyl phosphate
- Molecular formula
- C7H7O6P
- Molecular weight
- 218.1
Names & synonyms
fosfosal6064-83-1o-Carboxyphenyl phosphateAydolid2-Phosphonoxybenzoic acidSalicylic acid dihydrogen phosphateBenzoic acid, 2-(phosphonooxy)-FosfosalumDisodium salicylphosphateDTXSID9045394NSC-46475124X2V25W4
Show more names
ur1522ur1521disdolensalicylphosphatephosphonoxybenzoicacidSALICYLIC ACID PHOSPHATE2-phosphonoxybenzoicacid2-phosphonoxybenzoesaeure
DTXCID7025394SALICYLIC ACID PHOSPHATE DISODIUM SALTo-cpp cpdo-carboxyphenylphosphate2-Carboxyphenylphosphoric acidRefChem:141384227-993-5o-carboxyphenylphosphoric acid
Database identifiers
- CAS
6064-83-1- PubChem CID
- 3418
- DTXSID
DTXSID9045394- ChEMBL
CHEMBL287275- ChEBI
CHEBI:94564- UNII
- 124X2V25W4
- EC Number
- 227-993-5
- Nikkaji
- J8.342I
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 162 · 162-166°C
- Boiling point
- 482.3 · 482.3±47.0 °C(Predicted)
- Density
- 1.695 · 1.695±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 1.06 · 1.06±0.30(Predicted)
- form
- solid
- color
- White to off-white
- Water Solubility
- Soluble in water.
- Merck
- 14 · 14,4255
- BRN
- 2619142 · 2619142
- CAS DataBase Reference
- 6064 · 6064-83-1(CAS DataBase Reference)
- FDA UNII
- 124 X2V25W4 · 124X2V25W4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 301 · P301+P312a-P330-P501a-P264-P270-P301+P312+P330-P501
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- RTECS
- 2770000 · VO2770000
- HS Code
- 2919900090 · 2919900090
- Toxicity
- 50 in · LD50 in male, female mice, male, female rats at pH 1.0, aq soln (mg/kg): 94, 105, 153, 257 i.v.; 352, 253, 338, 360 i.p.; 1455, 1539, 1104, 1213 orally; at pH 3.5 (mg/kg): 117, 118, 207, 215 i.v.; 1592, 1483, 1085, 1128 i.p.; 1702, 2007, 1685, 2225 orally (Sanchez)
Safety & regulation
Safety data
- wgk
- 3
- rtecs
- VO2770000
- hs_code
- 2919900090
- Toxicity
- LD50 in male, female mice, male, female rats at pH 1.0, aq soln (mg/kg): 94, 105, 153, 257 i.v.; 352, 253, 338, 360 i.p.; 1455, 1539, 1104, 1213 orally; at pH 3.5 (mg/kg): 117, 118, 207, 215 i.v.; 1592, 1483, 1085, 1128 i.p.; 1702, 2007, 1685, 2225 orally (Sanchez)
- risk_code
- 22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-36
- Hazard statements
- H302
- Precautionary statements
- P301+P312a-P330-P501a-P264-P270-P301+P312+P330-P501
Chemistry & industry
Applications
DescriptionFosfosal is a highly water soluble salicylate useful in the treatment of musculoskeletal and arthritic pain. Unlike aspirin, it does not inhibit prostaglandin synthesis or platelet aggregation.
Uses2-Carboxyphenyl phosphate is used as a substrate for the estimation of acid phosphatase. It is also used as a analgesic, anti-inflammatory agent.
Usesanalgesic, antiinflammatory
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers38 total
北京华美互利生物化工010-56205725 · [email protected]
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Additional notes
DefinitionChEBI: 2-phosphonooxybenzoic acid is an aryl phosphate.
Related reactions
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