6-Bromo-2,3-dihydrobenzo[b]thiophene 1,1-Dioxide - CAS 61942-64-1
Catalog: |
BB031344 |
Product Name: |
6-Bromo-2,3-dihydrobenzo[b]thiophene 1,1-Dioxide |
CAS: |
61942-64-1 |
Synonyms: |
6-bromo-2,3-dihydro-1-benzothiophene 1,1-dioxide; 6-bromo-2,3-dihydro-1-benzothiophene 1,1-dioxide |
IUPAC Name: | 6-bromo-2,3-dihydro-1-benzothiophene 1,1-dioxide |
Description: | 6-Bromo-2,3-dihydrobenzo[b]thiophene 1,1-Dioxide (CAS# 61942-64-1) is a useful research chemical. |
Molecular Weight: | 247.11 |
Molecular Formula: | C8H7BrO2S |
Canonical SMILES: | C1CS(=O)(=O)C2=C1C=CC(=C2)Br |
InChI: | InChI=1S/C8H7BrO2S/c9-7-2-1-6-3-4-12(10,11)8(6)5-7/h1-2,5H,3-4H2 |
InChI Key: | FUHDZKNBAPRMHD-UHFFFAOYSA-N |
LogP: | 2.85970 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2018332887-A1 | Bisamide sarcomere activating compounds and uses thereof | 20170913 |
CA-3075669-A1 | Bisamide sarcomere activating compounds and uses thereof | 20170913 |
KR-20200054237-A | Bisamide muscle fibrillar node activating compound and use thereof | 20170913 |
TW-201920096-A | Diammine sarcomeric activation compound and use thereof | 20170913 |
US-2019077793-A1 | Bisamide sarcomere activating compounds and uses thereof | 20170913 |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.93501 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.93501 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 42.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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