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Environmental fate & pathways

Henry's Law constant

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Administrative data

Endpoint:
Henry's law constant
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

Reference
Reference Type:
other: Authoritative data base
Title:
Danish QSAR study for CAS No.: 5246-57-1
Author:
Danish EPA Model
Year:
2012
Bibliographic source:
QSAR predictions by Danish Environmental Protection Agency (EPA)model powered by OASIS database:-EPI Suite (HENRYWIN) 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:
The Henry’s law constant is estimated by means of the bond contribution.
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
2-[(3-aminophenyl)sulphonyl]ethanol
EC Number:
226-046-3
EC Name:
2-[(3-aminophenyl)sulphonyl]ethanol
Cas Number:
5246-57-1
Molecular formula:
C8H11NO3S
IUPAC Name:
2-(3-aminobenzenesulfonyl)ethan-1-ol
Details on test material:
- Name of test material (as cited in study report): 2-[(3-aminophenyl)sulphonyl]ethanol
- Substance type: Organic
- Physical state: Solid

Results and discussion

Henry's Law constant H
Temp.:
25 °C
Remarks on result:
other: Henry's constant: 0.0000000000000214 atm-m3/Mole

Applicant's summary and conclusion

Conclusions:
Henry's constant of 2-[(3-aminophenyl)sulphonyl]ethanol estimated as 0.0000000000000214 atm-m3/Mole by means of the bond contribution indicate Non volatile in nature.
Executive summary:

Henry's constant of 2-[(3-aminophenyl)sulphonyl]ethanol estimated as 0.0000000000000214 atm-m3/Mole by means of the bond contribution indicate Non volatile in nature.