CAS 1641-17-4 | Methanone, (2-hydroxy-4-methoxyphenyl)(4-methylphenyl)- | CAS Number 1641-17-4

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1641-17-4 | Methanone, (2-hydroxy-4-methoxyphenyl)(4-methylphenyl)-

CAS No: 1641-17-4 Catalog No: AG001UNV MDL No:MFCD00017172

Product Description

Catalog Number:

AG001UNV

Chemical Name:

Methanone, (2-hydroxy-4-methoxyphenyl)(4-methylphenyl)-

CAS Number:

1641-17-4

Molecular Formula:

C15H14O3

Molecular Weight:

242.2699

MDL Number:

MFCD00017172

IUPAC Name:

(2-hydroxy-4-methoxyphenyl)-(4-methylphenyl)methanone

InChI:

InChI=1S/C15H14O3/c1-10-3-5-11(6-4-10)15(17)13-8-7-12(18-2)9-14(13)16/h3-9,16H,1-2H3

InChI Key:

MJVGBKJNTFCUJM-UHFFFAOYSA-N

SMILES:

COc1ccc(c(c1)O)C(=O)c1ccc(cc1)C

EC Number:

216-688-2

UNII:

ET1UGF4A0B

NSC Number:

760432

Properties

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.274g/mol

Monoisotopic Mass:

242.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Miniaturized hollow fiber assisted liquid-phase microextraction and gas chromatography-mass spectrometry for determination of benzophenone and derivates in human urine sample.	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20090115
Simultaneous analysis of benzophenone sunscreen compounds in water sample by stir bar sorptive extraction with in situ derivatization and thermal desorption-gas chromatography-mass spectrometry.	Journal of chromatography. A 20080725
Measurement of benzophenones in human urine samples by stir bar sorptive extraction and thermal desorption-gas chromatography-mass spectrometry.	Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20080101
Causal agents of photoallergic contact dermatitis diagnosed in the national institute of dermatology of Colombia.	Photodermatology, photoimmunology & photomedicine 20060801
[Photoaggravated contact allergy and contact photoallergy caused by ketoprofen: 19 cases].	Annales de dermatologie et de venereologie 20011001