Registration Dossier
Registration Dossier
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EC number: 202-667-5 | CAS number: 98-42-0
Boiling point
Administrative data
- Endpoint:
- boiling point
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
Data source
Referenceopen allclose all
- Reference Type:
- other: Prediction model
- Title:
- Boiling point by EPI (Estimation Programs Interface) Suite
- Author:
- Sustainability Support Service (Europe) AB - estimated
- Year:
- 2 011
- Bibliographic source:
- Estimation Programs Interface Suite™ United States Environmental Protection Agency, Washington, DC, USA. version 4.1
- Reference Type:
- other: Authoritative data base
- Title:
- Danish QSAR study for CAS No.: 98-42-0
- Author:
- Danish EPA Model
- Year:
- 2 012
- Bibliographic source:
- QSAR predictions by Danish Environmental Protection Agency (EPA)model powered by OASIS database:-EPI Suite (MPBPVP) Various versions of EPI Suite dating back from 1990-2004
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- other: modelling database
- Principles of method if other than guideline:
- Data is from MPBPVP (v1.43) Program of EPI Suit etimation database.
- GLP compliance:
- no
- Type of method:
- other: Adapted Stein and Brown Method
Test material
- Reference substance name:
- 3-amino-4-methoxybenzenesulphonic acid
- EC Number:
- 202-667-5
- EC Name:
- 3-amino-4-methoxybenzenesulphonic acid
- Cas Number:
- 98-42-0
- Molecular formula:
- C7H9NO4S
- IUPAC Name:
- 3-amino-4-methoxybenzenesulphonic acid
- Test material form:
- other: Amorphous
- Details on test material:
- - Name of test material: 3-amino-4-methoxybenzenesulphonic acid
- Molecular formula: C7H9NO4S
- Molecular weight: 203.22
- Substance type: organic
- Physical state: Soild
Constituent 1
Results and discussion
Boiling point
- Boiling pt.:
- 386.91 °C
- Decomposition:
- no
- Remarks on result:
- other: Other details not available
Applicant's summary and conclusion
- Conclusions:
- Boiling point of 3-amino-4-methoxybenzenesulphonic acid was estimated to be 386.91°C by Adapted Stein and Brown Method.
- Executive summary:
According to EPI Suite and DEPA QSAR study boiling point of 3-amino-4-methoxybenzenesulphonic acid was estimated to be 386.91°C by Adapted Stein and Brown Method.
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