1-Cyclopentenecarboxylic acid - CAS 1560-11-8
Catalog: |
BB011194 |
Product Name: |
1-Cyclopentenecarboxylic acid |
CAS: |
1560-11-8 |
Synonyms: |
cyclopentene-1-carboxylic acid |
IUPAC Name: | cyclopentene-1-carboxylic acid |
Description: | 1-Cyclopentenecarboxylic Acid can be used for enantioselective 1,3-dipolar cycloadditions of diazoacetates and solid-phase synthesis of substituted indolines. It can also be used to develop antagonists for A1- and A2-adenosine receptors. |
Molecular Weight: | 112.13 |
Molecular Formula: | C6H8O2 |
Canonical SMILES: | C1CC=C(C1)C(=O)O |
InChI: | InChI=1S/C6H8O2/c7-6(8)5-3-1-2-4-5/h3H,1-2,4H2,(H,7,8) |
InChI Key: | PYRZPBDTPRQYKG-UHFFFAOYSA-N |
Boiling Point: | 210 °C |
Melting Point: | 121-124 °C (lit.) |
Purity: | 95 % |
Density: | 1.215 g/cm3 |
Appearance: | White to pale yellow powder |
MDL: | MFCD00001396 |
LogP: | 1.18130 |
GHS Hazard Statement: | H314 (13.64%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021117762-A1 | Resin composition, resin sheet, multilayer printed wiring board, and semiconductor device | 20191211 |
WO-2020223517-A1 | Methods of making oligopotent and unipotent precursors | 20190501 |
WO-2020163295-A1 | Chiral-substituted poly-n-vinylpyrrolidinones and complexes with bimetallic nanoclusters and uses thereof in asymmetric oxidation reactions | 20190204 |
EP-3813816-A1 | Use of (s)-3-amino-4-(difluoromethylenyl) cyclopent-1-ene-1-carboxylic acid and related compounds, (1s,3s)-3-amino-4-(difluoromethylidene) cyclopentane-1-carboxylic acid and vigabatrin in the treatment of developmental disorders | 20180607 |
WO-2019157273-A1 | Use of (1s,3s)-3-amino-4-(difluoromethylidene) cyclopentane-1-carboxylic acid and (s)-3-amino-4-(difluoromethylenyl)cyclopent-1-ene-1-carboxylic acid in the treatment of tinnitus, acute sensorineural hearing loss, meniere's disease, tourette's syndrome, attention deficit hyperactivity disorder and addiction | 20180208 |
PMID | Publication Date | Title | Journal |
21220428 | 20110325 | Selective orthosteric free fatty acid receptor 2 (FFA2) agonists: identification of the structural and chemical requirements for selective activation of FFA2 versus FFA3 | The Journal of biological chemistry |
19354281 | 20090507 | Asymmetric construction of three contiguous stereogenic centers by conjugate addition-alkylation of lithium ester enolate | Organic letters |
19115978 | 20090205 | Asymmetric construction of quaternary carbon centers by sequential conjugate addition of lithium amide and in situ alkylation: utility in the synthesis of (-)-aspidospermidine | Organic letters |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 112.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 112.052429494 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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