Ethyl 5-Bromothiophene-2-carboxylate - CAS 5751-83-7
Catalog: |
BB029733 |
Product Name: |
Ethyl 5-Bromothiophene-2-carboxylate |
CAS: |
5751-83-7 |
Synonyms: |
5-bromo-2-thiophenecarboxylic acid ethyl ester; ethyl 5-bromothiophene-2-carboxylate |
IUPAC Name: | ethyl 5-bromothiophene-2-carboxylate |
Description: | Ethyl 5-Bromothiophene-2-carboxylate (CAS# 5751-83-7) is a useful research chemical. |
Molecular Weight: | 235.10 |
Molecular Formula: | C7H7BrO2S |
Canonical SMILES: | CCOC(=O)C1=CC=C(S1)Br |
InChI: | InChI=1S/C7H7BrO2S/c1-2-10-7(9)5-3-4-6(8)11-5/h3-4H,2H2,1H3 |
InChI Key: | PZNHMXAOMDQLLE-UHFFFAOYSA-N |
Boiling Point: | 267.8 °C at 760 mmHg |
Density: | 1.572 g/cm3 |
MDL: | MFCD02683089 |
LogP: | 2.68730 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112939829-A | Synthetic method of aryl trifluoromethyl thioether | 20210304 |
WO-2021142247-A1 | Smarca2-vhl degraders | 20200110 |
JP-2021017541-A | Compounds, compositions, membranes, laminates and display devices | 20190723 |
JP-2021018406-A | Compositions, films, laminates and display devices | 20190723 |
US-2020000383-A1 | Near-ir glucose sensors | 20180627 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.93501 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.93501 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 54.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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