Phenyl formate - CAS 1864-94-4
Catalog: |
BB014327 |
Product Name: |
Phenyl formate |
CAS: |
1864-94-4 |
Synonyms: |
phenyl formate |
IUPAC Name: | phenyl formate |
Description: | Phenyl formate (CAS# 1864-94-4 ) is a useful research chemical. |
Molecular Weight: | 122.12 |
Molecular Formula: | C7H6O2 |
Canonical SMILES: | C1=CC=C(C=C1)OC=O |
InChI: | InChI=1S/C7H6O2/c8-6-9-7-4-2-1-3-5-7/h1-6H |
InChI Key: | GEOWCLRLLWTHDN-UHFFFAOYSA-N |
Boiling Point: | 165.2 °C at 760 mmHg |
Density: | 1.120 g/mL at 20 °C(lit.) |
MDL: | MFCD00014126 |
LogP: | 1.85770 |
GHS Hazard Statement: | H302 (88.37%): 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 |
US-2021188800-A1 | Lanthionine c-like protein 2 ligands, cells prepared therewith, and therapies using same | 20191220 |
WO-2021122945-A1 | Powdery, musky odorant macrocycles | 20191220 |
WO-2021123018-A1 | Soap composition | 20191220 |
WO-2021123144-A1 | Pro-perfume compositions | 20191220 |
WO-2021124043-A1 | Adhesive article comprising polymer and polymerizable cyclic olefins, adhesive compositions and methods | 20191220 |
PMID | Publication Date | Title | Journal |
22642678 | 20120615 | Palladium-catalyzed carbonylation of aryl, alkenyl, and allyl halides with phenyl formate | Organic letters |
22412532 | 20120301 | 9-(3-Fluoro-phen-oxy-carbon-yl)-10-methyl-acridinium trifluoro-methane-sulfonate monohydrate | Acta crystallographica. Section E, Structure reports online |
22211082 | 20120101 | Improved synthesis strategy for peptide nucleic acids (PNA) appropriate for cell-specific fluorescence imaging | International journal of medical sciences |
22199724 | 20111201 | 9-(2,5-Dimethyl-phen-oxy-carbon-yl)-10-methyl-acridinium trifluoro-methane-sulfonate | Acta crystallographica. Section E, Structure reports online |
21989535 | 20111026 | Formate dehydrogenase--a biocatalyst with novel applications in organic chemistry | Organic & biomolecular chemistry |
Complexity: | 84.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 122.036779430 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 122.036779430 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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