N-Phenylrhodanine - CAS 1457-46-1
Catalog: |
BB043403 |
Product Name: |
N-Phenylrhodanine |
CAS: |
1457-46-1 |
Synonyms: |
AKOS B029067; 3-PHENYLRHODANINE; 3-PHENYL-2-THIOXO-THIAZOLIDIN-4-ONE; 3-PHENYL-2-THIOXO-4-THIAZOLIDINONE; N-PHENYL-RHODANINE; 3-Phenyl-2-thioxo-1,3-thiazolidin-4-one; 3-Phenylrhodanide; 3-Phenylrhodanin |
IUPAC Name: | 3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one |
Description: | N-Phenylrhodanine (CAS# 1457-46-1 ) is a useful research chemical. |
Molecular Weight: | 209.29 |
Molecular Formula: | C9H7NOS2 |
Canonical SMILES: | C1C(=O)N(C(=S)S1)C2=CC=CC=C2 |
InChI: | InChI=1S/C9H7NOS2/c11-8-6-13-9(12)10(8)7-4-2-1-3-5-7/h1-5H,6H2 |
InChI Key: | DVRWEKGUWZINTQ-UHFFFAOYSA-N |
Purity: | 96.0 % (HPLC) |
Density: | 1.45 g/cm3 |
Appearance: | White to yellowish crystalline powder |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.99690619 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.99690619 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 77.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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