(4-(Dimethylamino)-2-methylphenyl)(hydroxy)oxophosphanium
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Basic information
- CAS
57808-64-7- Standard SMILES
Cc1cc(N(C)C)ccc1[P+](=O)O- InChIKey
KISUENOXDRDPHR-UHFFFAOYSA-N- Molecular formula
- C9H13NO2P+
- Average molar mass
- 198.18 g/mol
- Monoisotopic mass
- 198.06839066
Overview
Toldimfos is a small molecule drug. Toldimfos has a monoisotopic molecular weight of 199.08 Da.
Names & identifiers
- Preferred name
- (4-(Dimethylamino)-2-methylphenyl)(hydroxy)oxophosphanium
- IUPAC
- [4-(dimethylamino)-2-methylphenyl]-hydroxy-oxophosphanium
- English name
- Toldimfos
- Molecular formula
- C9H14NO2P
- Molecular weight
- 199.19
Names & synonyms
RefChem:1050381DTXCID50814917DTXSID90866652(4-(Dimethylamino)-2-methylphenyl)(hydroxy)oxophosphaniumToldimfos57808-64-7[4-(Dimethylamino)-2-methylphenyl]phosphinic acidPhosphijet[4-(dimethylamino)-2-methylphenyl]-hydroxy-oxophosphanium5X1442L8IOToldimfos (INN)TOLDIMFOS [INN]
Show more names
[4-(Dimethylamino)-o-tolyl]phosphinic acidPhosphinic acid, P-[4-(dimethylamino)-2-methylphenyl]-
(4-(Dimethylamino)-o-tolyl)phosphinic acidToldimfos [INN:BAN]UNII-5X1442L8IOPhosphijet (TN)TOLDIMFOS [WHO-DD]CHEMBL2105341SCHEMBL12791395DTXSID701224436
Database identifiers
- CAS
57808-64-7- PubChem CID
- 6328636
- DTXSID
DTXSID701224436- ChEMBL
CHEMBL2105341- UNII
- 5X1442L8IO
- Nikkaji
- J12.606C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 1
- Complexity
- 196
Physicochemical properties
- Boiling point
- 370.5 · 370.5±52.0 °C(Predicted)
- pka
- 1.36 · 1.36±0.58(Predicted)
- FDA UNII
- 5 X1442L8IO · 5X1442L8IO
Chemistry & industry
Pharmacology
ATC CodeQA - Alimentary tract and metabolism
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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