2,5-Dichlorothiophene-3-carboxylic acid - CAS 36157-41-2
Catalog: |
BB022884 |
Product Name: |
2,5-Dichlorothiophene-3-carboxylic acid |
CAS: |
36157-41-2 |
Synonyms: |
2,5-dichlorothiophene-3-carboxylic acid |
IUPAC Name: | 2,5-dichlorothiophene-3-carboxylic acid |
Description: | 2,5-Dichlorothiophene-3-carboxylic acid (CAS# 36157-41-2) is a useful research chemical. |
Molecular Weight: | 197.04 |
Molecular Formula: | C5H2Cl2O2S |
Canonical SMILES: | C1=C(SC(=C1C(=O)O)Cl)Cl |
InChI: | InChI=1S/C5H2Cl2O2S/c6-3-1-2(5(8)9)4(7)10-3/h1H,(H,8,9) |
InChI Key: | FBUUZRITKBLZJX-UHFFFAOYSA-N |
Boiling Point: | 296.6 ℃ at 760 mmHg |
Melting Point: | 147-151 ℃ (lit.) |
Purity: | 95 % |
Density: | 1.708 g/cm3 |
MDL: | MFCD00082908 |
LogP: | 2.75310 |
GHS Hazard Statement: | H302 (90.7%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110756172-A | Inorganic salt hazardous waste recycling treatment process | 20190710 |
WO-2020249664-A1 | Sulfonylurea derivatives and uses thereof | 20190612 |
WO-2019241311-A1 | Selective ligands for modulation of girk channels | 20180611 |
EP-3801504-A1 | Selective ligands for modulation of girk channels | 20180611 |
US-2021253561-A1 | Selective ligands for modulation of girk channels | 20180611 |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.9152559 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.9152559 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 65.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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Related Functional Groups
Carbonyl Compounds
Thiophenes
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