CAS Number: 2602-85-9
benzo[d]thiazole-2-carbonitrile
|
Structure |
![benzo[d]thiazole-2-carbonitrile](/Public/Uploads/55c08e2767b9c(1).gif) |
| Name: benzo[d]thiazole-2-carbonitrile |
| Synonyms: |
|
| General Information |
Product Number: 2602859
CAS Registry Number 2602-85-9
Name:
2-?Benzothiazolecarboni?trile
2-Cyanobenzothiazole
Chemical Formula: C8H4N2S
Exact Mass: 160.01
Molecular Weight: 160.20
m/z: 160.01 (100.0%), 161.01 (10.2%), 162.01 (4.7%)
InChI:InChI=1S/C8H4N2S/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H
InChI Key:UYHQUNLVWOAJQW-UHFFFAOYSA-N
Canonical SMILES:C1=CC=C2C(=C1)N=C(S2)C#N
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
80 °C |
|
(5)CAS |
| Melting Point |
71-73 °C |
|
(6)IC |
| Melting Point |
70 °C |
|
(7)IC |
|
Specification |
98%
|
| References |
- (5) Frere, Stephane; Synthetic Communications 2003, V33(21), P3795-3804 CAPLUS
- (6) Kristinsson, Haukur; Synthesis 1979, (2), P102-3 CAPLUS
- (7) Busby, Reginald E.; Journal of Chemical Research, Synopses 1980, (12), P408-9 CAPLUS
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