2-(1-Naphthylamino)-1,3-thiazol-4(5H)-one - CAS 398996-75-3
Catalog: |
BB048691 |
Product Name: |
2-(1-Naphthylamino)-1,3-thiazol-4(5H)-one |
CAS: |
398996-75-3 |
Synonyms: |
(2Z)-2-(1-naphthylimino)-1,3-thiazolidin-4-one; 2-(naphthylazamethylene)-1,3-thiazolidin-4-one; 2-(naphthalen-1-ylamino)-1,3-thiazol-4(5H)-one |
IUPAC Name: | 2-(naphthalen-1-ylamino)thiazol-4(5H)-one |
Description: | 2-(1-Naphthylamino)-1,3-thiazol-4(5H)-one (CAS# 398996-75-3 ) is a useful research chemical. |
Molecular Weight: | 242.30 |
Molecular Formula: | C13H10N2OS |
Canonical SMILES: | C1C(=O)NC(=NC2=CC=CC3=CC=CC=C32)S1 |
InChI: | InChI=1S/C13H10N2OS/c16-12-8-17-13(15-12)14-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2,(H,14,15,16) |
InChI Key: | PEVNNTKNJXSGGZ-UHFFFAOYSA-N |
Boiling Point: | 423.8±28.0 °C at 760 mmHg |
Purity: | ≥ 95 % |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 342 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.05138412 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.05138412 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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