6-Fluoro-alpha-methylbenzothiazole-2-methanol - CAS 782480-72-2
Catalog: |
BB036141 |
Product Name: |
6-Fluoro-alpha-methylbenzothiazole-2-methanol |
CAS: |
782480-72-2 |
Synonyms: |
1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol; 1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol |
IUPAC Name: | 1-(6-fluoro-1,3-benzothiazol-2-yl)ethanol |
Description: | 6-Fluoro-alpha-methylbenzothiazole-2-methanol (CAS# 782480-72-2 ) is a useful research chemical. |
Molecular Weight: | 197.23 |
Molecular Formula: | C9H8FNOS |
Canonical SMILES: | CC(C1=NC2=C(S1)C=C(C=C2)F)O |
InChI: | InChI=1S/C9H8FNOS/c1-5(12)9-11-7-3-2-6(10)4-8(7)13-9/h2-5,12H,1H3 |
InChI Key: | KMABBBXOJRAOKB-UHFFFAOYSA-N |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.03106321 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.03106321 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 61.4 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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Related Functional Groups
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