2-phenoxybenzaldehyde - CAS 19434-34-5
Catalog: |
BB015052 |
Product Name: |
2-phenoxybenzaldehyde |
CAS: |
19434-34-5 |
Synonyms: |
2-phenoxybenzaldehyde; 2-phenoxybenzaldehyde |
IUPAC Name: | 2-phenoxybenzaldehyde |
Description: | 2-phenoxybenzaldehyde (CAS# 19434-34-5) is used as a reagent in the synthesis of chiral 1,3,4-oxadiazol-2-ones as potent and highly selective FAAH inhibitors. Also used as a reagent in the synthesis of [4-(phenoxy)pyridin-3-yl]methylamines; a new class of selective noradrenaline reuptake inhibitors (NRI). |
Molecular Weight: | 198.22 |
Molecular Formula: | C13H10O2 |
Canonical SMILES: | C1=CC=C(C=C1)OC2=CC=CC=C2C=O |
InChI: | InChI=1S/C13H10O2/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12/h1-10H |
InChI Key: | IMPIIVKYTNMBCD-UHFFFAOYSA-N |
Boiling Point: | 114 °C / 0.1 mmHg |
Purity: | 95 % |
Density: | 1.154 g/cm3 |
MDL: | MFCD00800666 |
LogP: | 3.29140 |
GHS Hazard Statement: | H302 (97%): 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 |
EP-3696159-A1 | Process for the preparation of substituted phenoxyphenyl ketones | 20190214 |
EP-3696164-A1 | Process for the preparation of 4-nitro-2-(trifluoromethyl)-benzonitrile | 20190214 |
EP-3696165-A1 | Process for the preparation of 4-halophenoxy-2-trifluoromethyl benzonitrile | 20190214 |
EP-3670487-A1 | Process for the preparation of substituted phenoxyphenyl ketones | 20181218 |
EP-3670491-A1 | Process for the preparation of 4-nitro-2-trifluoromethyl-acetophenone | 20181218 |
PMID | Publication Date | Title | Journal |
21336645 | 20110901 | Enzymes-based resistant mechanism in pyrethroid resistant and susceptible Aedes aegypti strains from northern Thailand | Parasitology research |
22091114 | 20110801 | [2,7-Dimeth-oxy-8-(2-naphtho-yl)naphthalen-1-yl](naphthalen-2-yl)methanone | Acta crystallographica. Section E, Structure reports online |
Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.068079557 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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