4-(4-Chlorophenyl)-2-hydroxythiazole - CAS 2103-98-2
Catalog: |
BB016559 |
Product Name: |
4-(4-Chlorophenyl)-2-hydroxythiazole |
CAS: |
2103-98-2 |
Synonyms: |
4-(4-chlorophenyl)-3H-1,3-thiazol-2-one |
IUPAC Name: | 4-(4-chlorophenyl)-3H-1,3-thiazol-2-one |
Description: | 4-(4-Chlorophenyl)-2-hydroxythiazole (CAS# 2103-98-2) is a useful research chemical. |
Molecular Weight: | 211.67 |
Molecular Formula: | C9H6ClNOS |
Canonical SMILES: | C1=CC(=CC=C1C2=CSC(=O)N2)Cl |
InChI: | InChI=1S/C9H6ClNOS/c10-7-3-1-6(2-4-7)8-5-13-9(12)11-8/h1-5H,(H,11,12) |
InChI Key: | XODFWCAVOQHJFC-UHFFFAOYSA-N |
Boiling Point: | 410.2 °C at 760 mmHg |
Density: | 1.428 g/cm3 |
MDL: | MFCD02089965 |
LogP: | 2.75680 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-105636955-A | Tetrazolinone compound and application for same | 20131017 |
EP-3059233-A1 | Tetrazolinone compound and application for same | 20131017 |
EP-3059233-B1 | Tetrazolinone compound and application for same | 20131017 |
JP-6319317-B2 | Tetrazolinone compound and use thereof | 20131017 |
JP-WO2015056811-A1 | Tetrazolinone compounds and uses thereof | 20131017 |
Complexity: | 246 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.9858627 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.9858627 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 54.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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Oxazole/Thiazole
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