http://rdf.ncbi.nlm.nih.gov/pubchem/patent/JP-2012047652-A
Outgoing Links
| Predicate | Object |
|---|---|
| assignee | http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_16782a7197e06cf1817527f4cc239147 |
| classificationIPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G01N33-00 |
| filingDate | 2010-08-30-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| inventor | http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_7bca0d1063208549a5031e51cbe0fb77 |
| publicationDate | 2012-03-08-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationNumber | JP-2012047652-A |
| titleOfInvention | Method for predicting solubility parameters of chemical substances |
| abstract | A system for predicting solubility parameters of known and unknown chemicals is provided. A method of decomposing a chemical substance into fragments for each partial structure, determining an equation for predicting a dissolution parameter by multiple regression analysis, and calculating the solubility parameter of the chemical substance using the equation, The method for predicting the solubility parameter of a chemical substance, wherein the formula for predicting the solubility parameter is the following formula (1): δ = [(Σm i ΔE i + a) / V mol + b] 1/2 (1) Wherein, [delta] represents a solubility parameter, m i denotes the number of fragments i for each partial structure of chemicals, Delta] E i corresponding to the additivity contribution regarding vaporization energy of fragments i for each partial structure of chemicals V mol represents the molar volume of the chemical substance, and a and b represent constants. [Selection] Figure 3 |
| isCitedBy | http://rdf.ncbi.nlm.nih.gov/pubchem/patent/JP-2018173336-A |
| priorityDate | 2010-08-30-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| type | http://data.epo.org/linked-data/def/patent/Publication |
Incoming Links
Total number of triples: 217.