1-(3-Oxetanyl)piperazine - CAS 1254115-23-5

Catalog:	BB006116
Product Name:	1-(3-Oxetanyl)piperazine
CAS:	1254115-23-5
Synonyms:	1-(3-oxetanyl)piperazine; 1-(oxetan-3-yl)piperazine

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Computed Properties

IUPAC Name:	1-(oxetan-3-yl)piperazine
Description:	1-(3-Oxetanyl)piperazine (CAS# 1254115-23-5) is a useful research chemical.
Molecular Weight:	142.20
Molecular Formula:	C7H14N2O
Canonical SMILES:	C1CN(CCN1)C2COC2
InChI:	InChI=1S/C7H14N2O/c1-3-9(4-2-8-1)7-5-10-6-7/h7-8H,1-6H2
InChI Key:	AOYSLJHKVBSXRU-UHFFFAOYSA-N
LogP:	-0.44290

Publication Number	Title	Priority Date
CN-113200908-A	Tertiary amine-containing anthranilamide compound and preparation and application thereof	20210409
WO-2021198709-A1	Naphthyridine compounds as inhibitors of mer tyrosine kinase and axl tyrosine kinase	20200403
US-2021171543-A1	Mcl1 inhibitors	20191112
WO-2021096860-A1	Mcl1 inhibitors	20191112
CN-112778308-A	Fused tricyclic derivatives as FGFR4 inhibitors	20191109

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.110613074
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	142.110613074
Rotatable Bond Count:	1
Topological Polar Surface Area:	24.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.7