N-(1-Hydroxy-2-oxo-2-phenylethyl)benzamide - CAS 2166-87-2

Catalog:	BB058836
Product Name:	N-(1-Hydroxy-2-oxo-2-phenylethyl)benzamide
CAS:	2166-87-2
Synonyms:	N-(1-hydroxy-2-oxo-2-phenylethyl)benzamide

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Computed Properties

IUPAC Name:	N-(1-hydroxy-2-oxo-2-phenylethyl)benzamide
Description:	N-(1-hydroxy-2-oxo-2-phenylethyl)benzamide (cas# 2166-87-2) is a useful research chemical.
Molecular Weight:	255.27
Molecular Formula:	C15H13NO3
Canonical SMILES:	C1=CC=C(C=C1)C(=O)C(NC(=O)C2=CC=CC=C2)O
InChI:	InChI=1S/C15H13NO3/c17-13(11-7-3-1-4-8-11)15(19)16-14(18)12-9-5-2-6-10-12/h1-10,15,19H,(H,16,18)
InChI Key:	JWVPVXMVKOSSRU-UHFFFAOYSA-N

Publication Number	Title	Priority Date
CA-1270814-A	6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives	19850418
CS-255871-B2	Process for preparing derivatives of 6-/1-acyl-1-hydrohymethyl/-penicillanic acid	19850418
EP-0201221-A1	6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives	19850418
EP-0201221-B1	6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives	19850418
FI-85272-B	ANALOGIFICATE FARING FOR THERAPEUTIC USE OF THERAPEUTIC MEASURE 6- (1-ACYL-1-HYDROXIMETYL) PENICILLANSYRADERIVAT.	19850418
FI-85272-C	Analogous Process for Preparing Therapeutically Useful 6- (1-Acyl-1-Hydroxymethyl) Penicillanic Acid Derivatives	19850418
HU-196807-B	Process for producing 6-/1-acyl-1-hydroxy-methyl/-penicillanic acid derivatives	19850418
IE-58666-B1	6-(1-Acyl-1-hydroxymethyl) pencillanic acid derivatives	19850418
KR-880000974-B1	6- (1-acyl-1-hydroxymethyl) phenicylic acid derivative and preparation method thereof	19850418
PL-147619-B1	Method of obtaining novel derivatives of 6-/1-acyl-1-hydromethyl/penicillanic acid	19850418

PMID	Publication Date	Title	Journal
1959	19751101	[Comparative study of a new antihistamine, mequitazine, and placebos]	Acta allergologica

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P273, P301+P316, P321, P330, P391, P405, and P501
Signal Word:	Danger

Complexity:	317
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	255.08954328
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	255.08954328
Rotatable Bond Count:	4
Topological Polar Surface Area:	66.4Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1