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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

Name: Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
Brand: BOC Sciences
Rating: 5 (1 reviews)

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

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[87-88-7]C6H2Cl2O4
Chloranilic acid
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]C11H21ClO
Undecanoyl chloride
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

Fluorinated Building Blocks

[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1106917-71-8]C8H10ClF2NO
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[1795420-51-7]C6H6F3N3O2
3-Amino-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid
[1975118-13-8]C11H11F2N3
4-[3-(Difluoromethyl)-4-methyl-1H-pyrazol-1-yl]aniline

Piperazines

[25629-32-7]C6H10N2O3
(3-Oxopiperazin-1-yl)acetic acid
[55513-17-2]C11H14Cl2N2
1-(3,4-Dichlorobenzyl)piperazine
[16017-53-1]C10H13ClN2O2S
1-(4-Chloro-benzenesulfonyl)-piperazine
[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

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