2-chloro-1,3-benzothiazol-7-ol - CAS 96489-54-2
Catalog: |
BB041977 |
Product Name: |
2-chloro-1,3-benzothiazol-7-ol |
CAS: |
96489-54-2 |
Synonyms: |
2-chloro-1,3-benzothiazol-7-ol; 2-chloro-1,3-benzothiazol-7-ol |
IUPAC Name: | 2-chloro-1,3-benzothiazol-7-ol |
Description: | 2-chloro-1,3-benzothiazol-7-ol (CAS# 96489-54-2) is a useful research chemical. |
Molecular Weight: | 185.625 |
Molecular Formula: | C7H4ClNOS |
Canonical SMILES: | C1=CC2=C(C(=C1)O)SC(=N2)Cl |
InChI: | InChI=1S/C7H4ClNOS/c8-7-9-4-2-1-3-5(10)6(4)11-7/h1-3,10H |
InChI Key: | WNYYLFBWDIBLGA-UHFFFAOYSA-N |
MDL: | MFCD18415694 |
LogP: | 2.65530 |
Publication Number | Title | Priority Date |
KR-20190027385-A | Bicyclic heteroaryl substituted compounds | 20160714 |
US-2019292176-A1 | Bicyclic heteroaryl substituted compounds | 20160714 |
WO-2018013774-A1 | Bicyclic heteroaryl substituted compounds | 20160714 |
EP-3484878-B1 | Bicyclic heteroaryl substituted compounds | 20160714 |
US-2021163465-A1 | Bicyclic heteroaryl substituted compounds | 20160714 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.9702126 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.9702126 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 61.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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