1-(2-Furylmethyl)piperazine - CAS 59037-70-6

Catalog:	BB050187
Product Name:	1-(2-Furylmethyl)piperazine
CAS:	59037-70-6
Synonyms:	1-Furan-2-ylmethyl-piperazine; 2-(piperazinylmethyl)furan; 1-furfurylpiperazine; N-furfuryl piperazine; Piperazine, 1-(2-furanylmethyl)-

Technical Data

Safety and Hazards

Computed Properties

Related CAS:	1185304-05-5 (dihydrochloride)
IUPAC Name:	1-(furan-2-ylmethyl)piperazine
Description:	1-(2-Furylmethyl)piperazine (CAS# 59037-70-6 ) is a useful research chemical.
Molecular Weight:	166.22
Molecular Formula:	C9H14N2O
Canonical SMILES:	C1CN(CCN1)CC2=CC=CO2
InChI:	InChI=1S/C9H14N2O/c1-2-9(12-7-1)8-11-5-3-10-4-6-11/h1-2,7,10H,3-6,8H2
InChI Key:	GQSSZKRUQKGOJB-UHFFFAOYSA-N
Boiling Point:	243.5±25.0 °C at 760 mmHg
Purity:	≥ 95 %
Density:	1.1±0.1 g/cm³

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Related Functional Groups

Furans

[438219-08-0]
5-[(4-Chlorophenoxy)methyl]furan-2-carbaldehyde
[364628-38-6]
5-[(4-Chlorophenoxy)methyl]furan-2-carbohydrazide
[937599-96-7]
Ethyl {[4-(2-furyl)pyrimidin-2-YL]thio}acetate
[676643-01-9]
Ethyl 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
[1195901-63-3]
N-(2-Furylmethyl)-N-(Pyridin-2-Ylmethyl)Amine Dihydrochloride
[438530-89-3]
5-(4-Bromophenoxymethyl)furan-2-carbaldehyde

Piperazines

[1187874-30-1]
6-(4-(Piperazin-1-yl)-3-(trifluoromethyl)phenyl)pyridazin-3(2H)-one
[16017-53-1]
1-(4-Chloro-benzenesulfonyl)-piperazine
[55276-43-2]
1-Methanesulfonylpiperazine
[1191255-65-8]
Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
[120-43-4]
Ethyl 1-piperazinecarboxylate
[104481-24-5]
Ethyl 2-piperazin-1-yl-thiazole-4-carboxylate

GHS Hazard Statement:	H314 (33.33%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H315 (66.67%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (66.67%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	135
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.110613074
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	166.110613074
Rotatable Bond Count:	2
Topological Polar Surface Area:	28.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2