1-benzothiophen-5-ylmethanol - CAS 20532-34-7
Catalog: |
BB016050 |
Product Name: |
1-benzothiophen-5-ylmethanol |
CAS: |
20532-34-7 |
Synonyms: |
1-benzothiophen-5-ylmethanol; 1-benzothiophen-5-ylmethanol |
IUPAC Name: | 1-benzothiophen-5-ylmethanol |
Description: | 1-benzothiophen-5-ylmethanol (CAS# 20532-34-7) is a useful research chemical. |
Molecular Weight: | 164.222 |
Molecular Formula: | C9H8OS |
Canonical SMILES: | C1=CC2=C(C=CS2)C=C1CO |
InChI: | InChI=1S/C9H8OS/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,10H,6H2 |
InChI Key: | JSYSQUAJOCDMJW-UHFFFAOYSA-N |
Boiling Point: | 324 °C at 760 mmHg |
Density: | 1.294 g/cm3 |
Appearance: | Solid |
MDL: | MFCD04972640 |
LogP: | 2.39360 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264+P265, P280, P305+P351+P338, and P337+P317 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020308163-A1 | Compounds and compositions as modulators of tlr signaling | 20190326 |
TW-201925211-A | Method for preparing benzothiophen-2-ylborate | 20171025 |
JP-2020524132-A | Compositions and methods for treating Alzheimer's disease | 20170605 |
WO-2018055641-A1 | Oral modified release formulations | 20160920 |
US-10106553-B2 | Substituted benzothiophenyl derivatives as GPR40 agonists for the treatment of type II diabetes | 20160411 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.02958605 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.02958605 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 48.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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