Ethyl 2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate - CAS 4815-29-6
Catalog: |
BB026504 |
Product Name: |
Ethyl 2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
CAS: |
4815-29-6 |
Synonyms: |
2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester; ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
IUPAC Name: | ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
Description: | Ethyl 2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate (CAS# 4815-29-6) is a useful research chemical. |
Molecular Weight: | 211.28 |
Molecular Formula: | C10H13NO2S |
Canonical SMILES: | CCOC(=O)C1=C(SC2=C1CCC2)N |
InChI: | InChI=1S/C10H13NO2S/c1-2-13-10(12)8-6-4-3-5-7(6)14-9(8)11/h2-5,11H2,1H3 |
InChI Key: | BOJXCJDYZJSPMZ-UHFFFAOYSA-N |
Boiling Point: | 386.8 °C / 760 mmHg |
Density: | 1.282 g/cm3 |
Storage: | Keep in dark place. Sealed in dry. Keep cold. |
MDL: | MFCD00102063 |
LogP: | 2.57690 |
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 |
CN-111875615-A | Methoxybenzyl urea compound and application thereof | 20200715 |
WO-2021188907-A1 | Pyridinesulfonamide derivatives as trap1 modulators and uses thereof | 20200320 |
WO-2019154949-A1 | Fused thiophene derivatives and their uses | 20180208 |
EP-3749658-A1 | Fused thiophene derivatives and their uses | 20180208 |
US-2020369682-A1 | Fused thiophene derivatives and their uses | 20180208 |
PMID | Publication Date | Title | Journal |
11784142 | 20020117 | 2-Amino-3-aroyl-4,5-alkylthiophenes: agonist allosteric enhancers at human A(1) adenosine receptors | Journal of medicinal chemistry |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.06669983 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.06669983 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 80.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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