PAC Database - Detailed Chemical Data

Chemical Identity
Chemical CAS# UN# Health Code Numbers
Dinitrotoluene 25321-14-6 2038
17.00
13.00
4.01
15.02
4.08
4.05
7.01
7.00
11.00
4.07
Formula Synonyms
C7H6N2O4 DINITROTOLUENES, DINITROTOLUENES, LIQUID, DINITROTOLUENE (MIXED ISOMERS), DINITROPHENYLMETHANE, DINITROTOLUENE, DINITROTOLUENE (2,4 AND 2,6 MIX), DINITROTOLUENE (MIXED ISOMERS), DINITROTOLUÈNES (DOT FRENCH), DINITROTOLUENES, SOLID, DINITROTOLUÈNES, SOLIDES (DOT FRENCH), DINITROTOLUENOS (DOT SPANISH), DINITROTOLUENOS, SÓLIDOS (DOT SPANISH), DINITROTOLUOL, DNT, METHYLDINITROBENZENE, TDNT, TOLUENE, AR, AR-DINITRO, TOLUENE, AR,AR-DINITRO-
Physical Properties
Mol Wt State MP (°C) BP (°C) VP (Hg) VP (°C) SG LEL (ppm)
182.14 L or S 250 1.3208 @ 71°C
PAC Values
PAC Values (Original Units: mg/m3)
PAC-1 PAC-2 PAC-3
0.60 8.3 50
Converted PAC Values (ppm)
PAC-1 PAC-2 PAC-3
0.081 1.1 6.7
Technical Basis
Dinitrotoluene is a mixture of several isomers, consisting of approximately 80% 2,4-dinitrotoluene, 20% 2,6-dinitrotoluene and <5% 3,4-, 2,3- and 2,5-dinitrotoluenes. A review of available sources identified the following: IDLH and TLV-TWA exposure data for this substance. Data sources were selected according to the hierarchy listed in Table 3.1. Both the original and revised IDLH values were considered for TEEL-3 basis. The original IDLH (1990) basis was cat oral LDLo toxicity data, while the revised IDLH (1994) uses the exposure limits developed for a similar chemical, dinitrobenzene. The toxicological profile of this isomer mixture is expected to reflect the properties of its main constituents, 2,4-dinitrotoluene and 2,6-dinitrotoluene. Recent TEEL reviews have suggested that although 2,4-dinitrotoluene (CASRN: 121-14-2) and 2,6-dinitrotoluene (CASRN: 606-20-2) have different TEEL-3 values (53 mg/m3 and 12 mg/m3, respectively) they are similar in magnitude to the revised IDLH (50 mg/m3). Given that this substance is a mixture of dinitrotoluene isomers, as described above, and considering the TEEL-3 values of its main constituents, the revised IDLH (1994) value was selected as the TEEL-3. The TEEL-2 was derived according to Table 3.5. The TLV-TWA value was selected as the TEEL-1 basis.
• TEEL-1 = TLV-TWA (0.2 mg/m3) x 3
• TEEL-2 = TEEL-3/6
• TEEL-3 = IDLH (1994, 50 mg/m3)
This review generated TEEL-3 and TEEL-2 values that are more conservative than Rev. 29A. The Rev. 29A TEEL-3 was the original IDLH value (1990), while the current review selected the revised IDLH (1994). The 1994 IDLH was used according to Handbook guidelines (Section 4.2-4.3). The Rev. 29A and current TEEL-1 values and source are consistent. The Rev. 29A and current TEEL-2 methodology used are consistent, with differences in value due to the change in TEEL-3.
References
IDLH, dinitrotoluene: https://www.cdc.gov/niosh/idlh/25321146.html
Exposure limits, dinitrotoluene: https://www.osha.gov/chemicaldata/324
IDLH, dinitrobenzene: https://www.cdc.gov/niosh/idlh/528290.html
Description of mixture properties, see pg. 4, retrieved from: https://hpvchemicals.oecd.org/ui/handler.axd?id=02042b6f-37d6-4939-8731-952192affca4
Additional information regarding isomers: https://www.ncbi.nlm.nih.gov/books/NBK424337/
Description, as 2,3-dinitrotoluene: https://pubchem.ncbi.nlm.nih.gov/compound/2_3-Dinitrotoluene
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