2-(Trifluoromethyl)piperazine - CAS 131922-05-9

Name: 2-(Trifluoromethyl)piperazine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB007516
Product Name:	2-(Trifluoromethyl)piperazine
CAS:	131922-05-9
Synonyms:	2-(trifluoromethyl)piperazine

Technical Data

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Computed Properties

IUPAC Name:	2-(trifluoromethyl)piperazine
Description:	2-(Trifluoromethyl)piperazine (CAS# 131922-05-9) is a useful research chemical.
Molecular Weight:	154.13
Molecular Formula:	C5H9F3N2
Canonical SMILES:	C1CNC(CN1)C(F)(F)F
InChI:	InChI=1S/C5H9F3N2/c6-5(7,8)4-3-9-1-2-10-4/h4,9-10H,1-3H2
InChI Key:	YNEJOOCZWXGXDU-UHFFFAOYSA-N
Boiling Point:	145.1 °C at 760 mmHg
Density:	1.171 g/cm³
Appearance:	White to yellow powder
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
LogP:	0.76770

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Related Functional Groups

Piperazines

[1197237-96-9]C10H26Cl3N3
3-(4-Propylpiperazin-1-yl)propan-1-amine trihydrochloride
[55513-17-2]C11H14Cl2N2
1-(3,4-Dichlorobenzyl)piperazine
[104481-24-5]C10H15N3O2S
Ethyl 2-piperazin-1-yl-thiazole-4-carboxylate
[2171065-77-1]C24H26ClFN4O4S2
N1-(2-(4-(4-chloro-2-fluorophenyl)piperazin-1-yl)phenyl)-N4,N4-dimethylbenzene-1,4-disulfonamide
[510725-49-2]C10H15N3.HCl
1-(Pyridin-3-ylmethyl)piperazine hydroChloride
[27469-60-9]C17H18F2N2
1-Bis(4-fluorophenyl)methyl piperazine

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P273, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P391, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021209484-A1	Benzimidazole derivatives	20200416
WO-2021175200-A1	Ferroptosis inhibitorsâ€"diarylamine para-acetamides	20200302
US-2021113971-A1	Multi-layer membrane containing mixed polyamide selective layer and methods of making thereof	20191017
US-2021115570-A1	Method of inhibiting metal corrosion with a piperazine-based polyurea	20191016
WO-2021066958-A1	Inhibitor of btk and mutants thereof	20191005

Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.07178278
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	154.07178278
Rotatable Bond Count:	0
Topological Polar Surface Area:	24.1 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3