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1,3,5-Trichloro-Benzene
[CAS# 63697-19-8]

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Identification
Name 1,3,5-Trichloro-Benzene
Synonyms Hsdb 132; Nsc 4389; Sym-Trichlorobenzene
Molecular Structure CAS#: 63697-19-8, 1,3,5-Trichloro-Benzene
Molecular Formula C6H3Cl3
Molecular Weight 181.45
CAS Registry Number 63697-19-8
SMILES C1=C(C=C(Cl)C=C1Cl)Cl
InChI 1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKey XKEFYDZQGKAQCN-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Melting point 62-65°C (Expl.)
Boiling point 208°C (Expl.)
211.3±20.0°C at 760 mmHg (Cal.)
Flash point 126.667°C (Cal.)
126°C (Expl.)
Safety Data
Safety Code S36;S57;S60  Details
Risk Code R22;R51/53  Details
Hazard Symbol symbol  symbol  X;N  Details
Transport Information UN3077
Safety Description WARNING: Irritates skin and eyes, harmful if swallowed
References
(1) Linnan He and Peter C. Jurs. Assessing the Reliability of a QSAR Model's Predictions, J. Mol. Graphics Modell. 2005, 23(6), 503-523
Market Analysis Reports
List of Reports Available for 1,3,5-Trichloro-Benzene
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