Cyclopropyl 4-methoxyphenyl ketone - CAS 7152-03-6

Name: Cyclopropyl 4-methoxyphenyl ketone
Brand: BOC Sciences
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Catalog:	BB034416
Product Name:	Cyclopropyl 4-methoxyphenyl ketone
CAS:	7152-03-6
Synonyms:	cyclopropyl-(4-methoxyphenyl)methanone

Technical Data

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Computed Properties

IUPAC Name:	cyclopropyl-(4-methoxyphenyl)methanone
Description:	Cyclopropyl 4-methoxyphenyl ketone (CAS# 7152-03-6) is a useful research chemical.
Molecular Weight:	176.21
Molecular Formula:	C11H12O2
Canonical SMILES:	COC1=CC=C(C=C1)C(=O)C2CC2
InChI:	InChI=1S/C11H12O2/c1-13-10-6-4-9(5-7-10)11(12)8-2-3-8/h4-8H,2-3H2,1H3
InChI Key:	YKZSVEVTRUSPOQ-UHFFFAOYSA-N
Boiling Point:	94-97 °C (0.1 mmHg)
Density:	1.142 g/cm³
Appearance:	Light yellow crystals
MDL:	MFCD00001296
LogP:	2.28790

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Related Functional Groups

Carbonyl Compounds

[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid
[1016519-61-1]C8H10N2O2
2-(Methyl-2-pyridylamino)acetic Acid

Publication Number	Title	Priority Date
US-10174037-B2	Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors	20150604
US-2018148453-A1	Dihydropyrazolopyrimidinone compounds as pde2 inhibitors	20150604
AU-2012255690-A1	Amine derivatives as potassium channel blockers	20110516
AU-2012255690-B2	Amine derivatives as potassium channel blockers	20110516
EP-2524912-A1	Amine derivatives	20110516

PMID	Publication Date	Title	Journal
19531015	20090801	Synthesis and some reactions of dibutyltin (S)- and (R)-camphorsulfonyl hydrides	Combinatorial chemistry & high throughput screening
16599615	20060414	Oxygen acidity of ring methoxylated 1,1-diarylalkanol radical cations bearing alpha-cyclopropyl groups. The competition between O-neophyl shift and C-cyclopropyl beta-scission in the intermediate 1,1-diarylalkoxyl radicals	The Journal of organic chemistry
15115392	20040506	Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening	Journal of medicinal chemistry

Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	176.083729621
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	176.083729621
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2