α,α,α-trifluoro-3-tolyl isocyanate

Other distribution data

Administrative data

Endpoint:

other distribution data

Type of information:

calculation (if not (Q)SAR)

Adequacy of study:

other information

Reliability:

4 (not assignable)

Rationale for reliability incl. deficiencies:

results derived from a (Q)SAR model, with limited documentation / justification

Data source

Reference

Reference Type:

other company data

Title:

Unnamed

Year:

1995

Materials and methods

Principles of method if other than guideline:

Method: other: PIWIN, Estimation Program, Syracuse Research Corporation, Syracuse, NY 13210

Type of study:

volatility

Media:

water - air

Test material

Test material information

Constituent 1

Reference substance name:

α,α,α-trifluoro-3-tolyl isocyanate

EC Number:

206-341-3

EC Name:

α,α,α-trifluoro-3-tolyl isocyanate

Cas Number:

329-01-1

Molecular formula:

C8H4F3NO

IUPAC Name:

1-isocyanato-3-(trifluoromethyl)benzene

Constituent 2

Reference substance name:

alpha,alpha,alpha-trifluoro-3-tolyl isocyanate

IUPAC Name:

alpha,alpha,alpha-trifluoro-3-tolyl isocyanate

Results and discussion

Any other information on results incl. tables

Calculation of Henry coefficient 
Bond Estimation method
Henry coefficient (25 deg. C) : 2.02E,03 atm-m3/mol
                                8.27E,02 without unit