Product Number: 41963206
CAS Registry Number 41963-20-6
Name:
Benzonitrile, 4-bromo-3-methyl-
1-Bromo-4-cyano-2-methylbenzene
3-Methyl-4-bromobenzonitrile
3-Methyl-4-bromocyanobenzene
4-Bromo-3-methylbenzonitrile
4-Bromo-m-tolunitrile
Chemical Formula: C8H6BrN
Exact Mass: 194.97
Molecular Weight: 196.04
m/z: 194.97 (100.0%), 196.97 (97.3%), 195.97 (9.1%), 197.97 (8.5%)
InChI:InChI=1S/C8H6BrN/c1-6-4-7(5-10)2-3-8(6)9/h2-4H,1H3
InChI Key:SKXUZFJOLNNWIG-UHFFFAOYSA-N
Canonical SMILES:CC1=C(C=CC(=C1)C#N)Br
| Thermal Properties |
Value |
Condition |
Note |
| Boiling Point |
107-110 °C |
Press: 3 Torr |
(1)CAS |
| Boiling Point |
100 °C |
Press: 0.5 Torr |
(2)IC |
| Boiling Point |
78-82 °C |
Press: 0.3 Torr |
(3)IC |
| Melting Point |
87-89 °C |
|
(4)CAS |
| Melting Point |
55 °C |
|
(5)CAS |
| Melting Point |
55 °C |
Solv: ligroine (8032-32-4) |
(2)IC |
| Melting Point |
54-55 °C |
|
(1)CAS |
|
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