| Weight | 178.26 g/mol |
|---|---|
| Formula | C9H10N2S |
| Hydrogen Acceptors | 3 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 0 |
2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile (4651-91-6)
4651-91-6
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- 2-[(2-Chlorobenzylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3- carbonitrile (Acta Crystallographica Section E-structure Reports Online, 2011)
- Synthesis, spectroscopic and crystal structure analysis of 2-amino-5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile and-3-carboxamide (Journal of Chemical Research-s, 2009)
- 2-Amino-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile (Acta Crystallographica Section E-structure Reports Online, 2010)
- 2-Amino-4-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile (Acta Crystallographica Section E-structure Reports Online, 2011)
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 4651-91-6
-
SMILESC1CCC2=C(C1)C(=C(S2)N)C#N
-
InChIKeyADHVMGAFAKSNOM-UHFFFAOYSA-N
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Alternate Names
Estimated Properties
| Boiling Point | 304.88 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 333.95 C | EPI Suite |
| Density | 1.3 g/cm3 | EPA T.E.S.T. |
| Flash Point | 158.89 C | EPA T.E.S.T. |
| Melting Point | 118.28 C | EPI Suite |
| Water Solubility | 73.83 mg/L | EPA T.E.S.T. |
| Water Solubility | 492.3 mg/L | EPI Suite |
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