N-[2-(2-Thienyl)ethyl]formamide - CAS 28783-49-5
Catalog: |
BB057437 |
Product Name: |
N-[2-(2-Thienyl)ethyl]formamide |
CAS: |
28783-49-5 |
Synonyms: |
N-(2-thiophen-2-ylethyl)formamide; N-[2-(2-Thienyl)ethyl]formamide; N-(2-(thiophen-2-yl)ethyl)formamide; N-(2-(2-thienyl)ethyl)formamide |
IUPAC Name: | N-(2-thiophen-2-ylethyl)formamide |
Description: | N-[2-(2-Thienyl)ethyl]formamide is a sulfur analog of Isoquinolines. N-[2-(2-Thienyl)ethyl]formamide have been used in attempts to prepare analogs of papaverine (P190500). |
Molecular Weight: | 155.22 |
Molecular Formula: | C7H9NOS |
Canonical SMILES: | C1=CSC(=C1)CCNC=O |
InChI: | InChI=1S/C7H9NOS/c9-6-8-4-3-7-2-1-5-10-7/h1-2,5-6H,3-4H2,(H,8,9) |
InChI Key: | HBWLGAIQNVAFGS-UHFFFAOYSA-N |
Solubility: | Chloroform, DCM, Ethyl Acetate |
Appearance: | Colourless Oil |
Storage: | -20°C Freezer |
References: | Herz, W., et al. J. Am. Chem. Soc., 77, 3529 (1955). |
Complexity: | 108 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.04048508 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.04048508 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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