3-Phenylcyclobutanone - CAS 52784-31-3
Catalog: |
BB027946 |
Product Name: |
3-Phenylcyclobutanone |
CAS: |
52784-31-3 |
Synonyms: |
3-phenylcyclobutan-1-one |
IUPAC Name: | 3-phenylcyclobutan-1-one |
Description: | 3-Phenylcyclobutanone (CAS# 52784-31-3) is a useful research chemical. |
Molecular Weight: | 146.19 |
Molecular Formula: | C10H10O |
Canonical SMILES: | C1C(CC1=O)C2=CC=CC=C2 |
InChI: | InChI=1S/C10H10O/c11-10-6-9(7-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
InChI Key: | BVQSFCUGCAZOJQ-UHFFFAOYSA-N |
Boiling Point: | 258 °C at 760 mmHg |
Density: | 1.11 g/cm3 |
MDL: | MFCD04038993 |
LogP: | 2.13310 |
GHS Hazard Statement: | H302 (50%): 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 |
WO-2020108579-A1 | Amino-substituted pyridone derivative, preparation method therefor, and pharmaceutical use thereof | 20181128 |
US-2019269679-A1 | Hydroxy isoxazole compounds useful as gpr120 agonists | 20161215 |
US-10864211-B2 | Hydroxy isoxazole compounds useful as GPR120 agonists | 20161215 |
CN-105665016-A | Immobilized fluorine-containing alcohol, method for preparing same and application of immobilized fluorine-containing alcohol | 20160124 |
CN-105665016-B | A kind of immobilized fluorine-containing alcohol and preparation method and application | 20160124 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.073164938 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.073164938 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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