(S)-2-(2-Chlorophenyl)oxirane - CAS 141394-10-7
Catalog: |
BB009174 |
Product Name: |
(S)-2-(2-Chlorophenyl)oxirane |
CAS: |
141394-10-7 |
Synonyms: |
(2S)-2-(2-chlorophenyl)oxirane; (2S)-2-(2-chlorophenyl)oxirane |
IUPAC Name: | (2S)-2-(2-chlorophenyl)oxirane |
Description: | (S)-2-(2-Chlorophenyl)oxirane (CAS# 141394-10-7) is used as a reagent to synthesize triazoles (e.g. T296320) and tetrazoles, compounds that act as anticonvulsants and could potentially be used to treat disorders such as ADHD, stroke and neurodegeneration. |
Molecular Weight: | 154.59 |
Molecular Formula: | C8H7ClO |
Canonical SMILES: | C1C(O1)C2=CC=CC=C2Cl |
InChI: | InChI=1S/C8H7ClO/c9-7-4-2-1-3-6(7)8-5-10-8/h1-4,8H,5H2/t8-/m1/s1 |
InChI Key: | RTPJBMWUVSTBPC-MRVPVSSYSA-N |
LogP: | 2.41130 |
Publication Number | Title | Priority Date |
AU-2006237798-A1 | Neurotherapeutic azole compounds | 20050422 |
AU-2006237798-B2 | Neurotherapeutic azole compounds | 20050422 |
CA-2606258-A1 | Neurotherapeutic azole compounds | 20050422 |
CA-2606258-C | Neurotherapeutic azole compounds | 20050422 |
EP-1879873-A1 | Neurotherapeutic azole compounds | 20050422 |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.0185425 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.0185425 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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