1,4-dibromonaphthalene

Melting point / freezing point

Administrative data

Endpoint:

melting point/freezing point

Type of information:

(Q)SAR

Adequacy of study:

weight of evidence

Reliability:

2 (reliable with restrictions)

Rationale for reliability incl. deficiencies:

results derived from a valid (Q)SAR model and falling into its applicability domain, with limited documentation / justification

Justification for type of information:

1. SOFTWARE
US EPA. 2012. Estimation Programs Interface Suite™ for Microsoft® Windows, v 4.11. United States Environmental Protection Agency, Washington, DC, USA.
Recommended by ECHA.

2. MODEL (incl. version number)
EpiSuite v4.11 - MPBPVP v1.43

3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL
SMILES : c12c(c(ccc1Br)Br)cccc2
CHEM :
MOL FOR: C10 H6 Br2
MOL WT : 285.97

4. SCIENTIFIC VALIDITY OF THE (Q)SAR MODEL
5. APPLICABILITY DOMAIN
6. ADEQUACY OF THE RESULT

Justification is attached in 'Attached justification' below.

Data source

Reference

Reference Type:

other: QSAR summary

Title:

Epi Summary - 1,4-Dibromonaphtalene

Author:

Epi Suite

Year:

2018

Bibliographic source:

Epi Suite

Materials and methods

Test guideline

Qualifier:

no guideline followed

Principles of method if other than guideline:

- Software tool(s) used including version: Epi Suite V4.11
- Model(s) used: MPBPVP v1.43
- Model description: see field 'Attached justification'
- Justification of QSAR prediction: see field 'Attached justification'

GLP compliance:

no

Test material

Test material information

Constituent 1

Reference substance name:

1,4-dibromonaphthalene

EC Number:

201-484-8

EC Name:

1,4-dibromonaphthalene

Cas Number:

83-53-4

Molecular formula:

C10H6Br2

IUPAC Name:

1,4-dibromonaphthalene

Results and discussion

Melting / freezing point

Key result

Melting / freezing pt.:

91.76 °C

Atm. press.:

1 atm

Remarks on result:

other: QSAR