Ethanol, 2-[(methyl-2-thienylmethylene)amino]-
Basic information
- CAS
55956-24-6- Standard SMILES
CC(=NCCO)c1cccs1- InChIKey
VPJUJFYITYBMOF-UHFFFAOYSA-N- Molecular formula
- C8H11NOS
- Average molar mass
- 169.25 g/mol
- Monoisotopic mass
- 169.05613515
Names & identifiers
- Preferred name
- Ethanol, 2-[(methyl-2-thienylmethylene)amino]-
- IUPAC
- 2-(1-thiophen-2-ylethylideneamino)ethanol
- English name
- 2-[[Methyl(2-thienyl)methylene]amino]ethanol
- Molecular formula
- C8H11NOS
- Molecular weight
- 169.24
Names & synonyms
Ethanol, 2-[(methyl-2-thienylmethylene)amino]-VPJUJFYITYBMOF-VQHVLOKHSA-N2-([(E)-1-(2-Thienyl)ethylidene]amino)ethanol #Ethanol, 2-[[1-(2-thienyl)ethylidene]amino]-2-[[Methyl(2-thienyl)methylene]amino]ethanol
Database identifiers
- CAS
55956-24-6- PubChem CID
- 566428
- Nikkaji
- J122.139F
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 147
Physicochemical properties
- Boiling point
- 262.2 · 262.2±36.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- pka
- 14.66 · 14.66±0.10(Predicted)
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Related reactions
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Compound notes
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