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Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate

Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate - CAS 1191255-65-8

Catalog:	BB051151
Product Name:	Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
CAS:	1191255-65-8
Synonyms:	1-Piperazineacetic acid, 4-(3,3,3-trifluoropropyl)-, ethyl ester; Ethyl [4-(3,3,3-trifluoropropyl)-1-piperazinyl]acetate

Technical Data

Computed Properties

IUPAC Name:	ethyl 2-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
Molecular Weight:	268.28
Molecular Formula:	C11H19F3N2O2
Canonical SMILES:	CCOC(=O)CN1CCN(CC1)CCC(F)(F)F
InChI:	InChI=1S/C11H19F3N2O2/c1-2-18-10(17)9-16-7-5-15(6-8-16)4-3-11(12,13)14/h2-9H2,1H3
InChI Key:	BEOFURLNJTXMKE-UHFFFAOYSA-N
Boiling Point:	280.1±40.0°C (Predicted)
Purity:	≥95%
Density:	1.150±0.06 g/cm3 (Predicted)

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
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[5650-34-0]
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[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid

Fluorinated Building Blocks

[479552-94-8]
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[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[452-76-6]
2,4-Difluorotoluene
[1597-32-6]
2-Amino-6-fluoropyridine
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile

Piperazines

[1197237-96-9]
3-(4-Propylpiperazin-1-yl)propan-1-amine trihydrochloride
[1217482-26-2]
(R)-piperazin-2-ylmethanol dihydrochloride
[120-43-4]
Ethyl 1-piperazinecarboxylate
[1197236-47-7]
Ethyl 4-[2-(4-amino-3-methylpyrazol-1-yl)propanoyl]piperazine-1-carboxylate hydrochloride
[2171065-77-1]
N1-(2-(4-(4-chloro-2-fluorophenyl)piperazin-1-yl)phenyl)-N4,N4-dimethylbenzene-1,4-disulfonamide
[243128-46-3]
1-(4-Fluoro-2-nitrophenyl)piperazine

Complexity:	264
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	268.13986234
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	268.13986234
Rotatable Bond Count:	6
Topological Polar Surface Area:	32.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8