1-(4-(1h-Pyrrol-1-yl)phenyl)ethanone oxime - CAS 832738-15-5

Catalog:	BB046048
Product Name:	1-(4-(1h-Pyrrol-1-yl)phenyl)ethanone oxime
CAS:	832738-15-5
Synonyms:	(1E)-N-hydroxy-1-[4-(1H-pyrrol-1-yl)phenyl]ethanimine; 1-(4-Pyrrol-1-yl-phenyl)-ethanone oxime; 1-(hydroxyimino)-1-(4-pyrrolylphenyl)ethane

Technical Data

Computed Properties

IUPAC Name:	(NE)-N-[1-(4-pyrrol-1-ylphenyl)ethylidene]hydroxylamine
Description:	1-(4-(1h-Pyrrol-1-yl)phenyl)ethanone oxime (CAS# 832738-15-5 ) is a useful research chemical.
Molecular Weight:	200.24
Molecular Formula:	C12H12N2O
Canonical SMILES:	CC(=NO)C1=CC=C(C=C1)N2C=CC=C2
InChI:	InChI=1S/C12H12N2O/c1-10(13-15)11-4-6-12(7-5-11)14-8-2-3-9-14/h2-9,15H,1H3/b13-10+
InChI Key:	PXPFQUACXGFCRJ-JLHYYAGUSA-N
Boiling Point:	351.6±25.0 °C at 760 mmHg
Density:	1.1±0.1 g/cm³

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Related Functional Groups

Nitrogen Compounds

[937273-31-9]
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile

Oxygen Compounds

[77987-49-6]
Z-Glycinol
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[2960-93-2]
2,2'-Dimethoxy-1,1'-binaphthalene
[861434-97-1]
3-(2-Chloro-6-methylphenoxy)-5-nitroaniline

Pyrroles

[1551432-13-3]
3,6-Bis(2,4-dimethyl-1-pyrrolyl)-1,2,4,5-tetrazine
[168102-05-4]
Ethyl 3-Fluoropyrrole-2-carboxylate
[1263208-95-2]
Ethyl 3-methyl-4-(thiophene-2-carbonyl)-1H-pyrrole-2-carboxylate
[1290536-79-6]
1,1-Dimethylethyl N-[(5S,8S,10aR)-8-[[(diphenylmethyl)amino]carbonyl]decahydro-3-(3-methyl-1-oxobutyl)-6-oxopyrrolo[1,2-a][1,5]diazocin-5-yl]carbamate
[68471-57-8]
N-Benzyloxycarbonyl-2,3-dihydropyrrole
[2051-97-0]
N-Benzylpyrrole

Complexity:	226
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	200.094963011
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	200.094963011
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3