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CAS Number: 69321-60-4
1,3-dibromo-2-methylbenzene

Structure

 1,3-dibromo-2-methylbenzene
Name: 1,3-dibromo-2-methylbenzene
Synonyms:
General Information
Product Number: 69321604

CAS Registry Number 69321-60-4
Name:
Benzene, 1,?3-?dibromo-?2-?methyl-
1,3-Dibromo-2-methylbenzene
2,6-Dibromotoluene

 

Chemical Formula: C7H6Br2
Exact Mass: 247.88
Molecular Weight: 249.93
m/z: 249.88 (100.0%), 247.88 (51.4%), 251.88 (48.6%), 250.88 (7.6%), 248.89 (3.9%), 252.88 (3.7%)

 

InChI:InChI=1S/C7H6Br2/c1-5-6(8)3-2-4-7(5)9/h2-4H,1H3

InChI Key:OCSKCBIGEMSDIS-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C=CC=C1Br)Br

 

Thermal Properties Value Condition Note
Boiling Point 243 °C Press: 753 Torr (1)CAS
Boiling Point 164 °C Press: 760 Torr (2)CAS
Boiling Point 123-125 °C Press: 23 Torr (3)IC

Specification

98%
References
  1. (1) Lock, Gunther; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1935, V68B, P1505-11 CAPLUS
  2. (2) Barbero, Margherita; Synthesis 2008, (3), P474-478 CAPLUS
  3. (3) Yamato, Takehiko; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1987, (1), P1-7 CAPLUS
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