1-(2-Fluoro-4-nitrophenyl)-4-methylpiperazine - CAS 221198-29-4

Name: 1-(2-Fluoro-4-nitrophenyl)-4-methylpiperazine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017396
Product Name:	1-(2-Fluoro-4-nitrophenyl)-4-methylpiperazine
CAS:	221198-29-4
Synonyms:	1-(2-fluoro-4-nitrophenyl)-4-methylpiperazine; 1-(2-fluoro-4-nitrophenyl)-4-methylpiperazine

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2-fluoro-4-nitrophenyl)-4-methylpiperazine
Description:	1-(2-Fluoro-4-nitrophenyl)-4-methylpiperazine (CAS# 221198-29-4) is a useful research chemical.
Molecular Weight:	239.25
Molecular Formula:	C11H14FN3O2
Canonical SMILES:	CN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])F
InChI:	InChI=1S/C11H14FN3O2/c1-13-4-6-14(7-5-13)11-3-2-9(15(16)17)8-10(11)12/h2-3,8H,4-7H2,1H3
InChI Key:	UWZIHNDVFUJRHD-UHFFFAOYSA-N
Boiling Point:	365.6 °C at 760 mmHg
Density:	1.267 g/cm³
MDL:	MFCD02633484
LogP:	2.01180

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Related Functional Groups

Piperazines

[1187874-30-1]C15H15F3N4O
6-(4-(Piperazin-1-yl)-3-(trifluoromethyl)phenyl)pyridazin-3(2H)-one
[55276-43-2]C5H12N2O2S
1-Methanesulfonylpiperazine
[1191255-65-8]C11H19F3N2O2
Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
[1197236-47-7]C14H24ClN5O3
Ethyl 4-[2-(4-amino-3-methylpyrazol-1-yl)propanoyl]piperazine-1-carboxylate hydrochloride
[1095010-42-6]C11H15N3O4S
N-(5-Methylsulphonyl-2-nitrophenyl)piperazine
[1423024-26-3]C6H17Cl3N6
N''-(piperazine-1-carboximidoyl)guanidine trihydrochloride

Publication Number	Title	Priority Date
WO-2020192581-A1	Wee1 inhibitor and preparation and use thereof	20190322
CN-111718348-A	WEE1 inhibitor, and preparation and application thereof	20190322
CA-3043945-A1	8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6h)-ones	20161116
EP-3543242-A1	8,9-dihydroimidazole[1,2-a]pyrimido[5,4-e]pyrimidine-5(6h)-ketone compound	20161116
JP-2020502065-A	8,9-dihydroimidazole [1,2-a] pyrimido [5,4-e] pyrimidine-5 (6H) -ketone compound	20161116

Complexity:	276
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	239.10700486
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	239.10700486
Rotatable Bond Count:	1
Topological Polar Surface Area:	52.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8