1-(1,3-Dioxolan-2-ylmethyl)piperazine - CAS 682802-92-2

Catalog:	BB033508
Product Name:	1-(1,3-Dioxolan-2-ylmethyl)piperazine
CAS:	682802-92-2
Synonyms:	1-(1,3-dioxolan-2-ylmethyl)piperazine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(1,3-dioxolan-2-ylmethyl)piperazine
Description:	1-(1,3-Dioxolan-2-ylmethyl)piperazine (CAS# 682802-92-2) is a useful research chemical.
Molecular Weight:	172.22
Molecular Formula:	C8H16N2O2
Canonical SMILES:	C1CN(CCN1)CC2OCCO2
InChI:	InChI=1S/C8H16N2O2/c1-3-10(4-2-9-1)7-8-11-5-6-12-8/h8-9H,1-7H2
InChI Key:	SVNRBBGYRRYAMG-UHFFFAOYSA-N
Boiling Point:	80 °C
Density:	1.492 g/mL at 20°C(lit.)
LogP:	-0.46880

Publication Number	Title	Priority Date
US-10300075-B2	Compounds that inhibit MCL-1 protein	20170330
US-10632128-B2	Compounds that inhibit Mcl-1 protein	20170330
US-2019009268-A1	Process for Stripping Carbamate from Ion Exchange Resin	20150820
US-10898891-B2	Process for stripping carbamate from ion exchange resin	20150820
CN-104046246-A	Chemical Mechanical Planarization for Tungsten-Containing Substrates	20130312

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Related Functional Groups

Piperazines

[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[16017-53-1]
1-(4-Chloro-benzenesulfonyl)-piperazine
[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
[1197236-47-7]
Ethyl 4-[2-(4-amino-3-methylpyrazol-1-yl)propanoyl]piperazine-1-carboxylate hydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501
Signal Word:	Warning

Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.121177757
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	172.121177757
Rotatable Bond Count:	2
Topological Polar Surface Area:	33.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8