3-Isopropoxyazetidine Hydrochloride - CAS 871657-49-7

Catalog:	BB038307
Product Name:	3-Isopropoxyazetidine Hydrochloride
CAS:	871657-49-7
Synonyms:	3-propan-2-yloxyazetidine;hydrochloride; 3-propan-2-yloxyazetidine;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-propan-2-yloxyazetidine;hydrochloride
Description:	3-Isopropoxyazetidine Hydrochloride (CAS# 871657-49-7) is a useful research chemical.
Molecular Weight:	151.63
Molecular Formula:	C6H14ClNO
Canonical SMILES:	CC(C)OC1CNC1.Cl
InChI:	InChI=1S/C6H13NO.ClH/c1-5(2)8-6-3-7-4-6;/h5-7H,3-4H2,1-2H3;1H
InChI Key:	QSKVFUMEPLXIRZ-UHFFFAOYSA-N
LogP:	1.51400

Publication Number	Title	Priority Date
WO-2019166824-A1	Oxadiazolylthiophene derivatives useful as histone deacetylase inhibitors	20180301
CN-112004814-A	Oxadiazolyl thiophene derivatives useful as inhibitors of histone deacetylase	20180301
EP-3759106-A1	Oxadiazolylthiophene derivatives useful as histone deacetylase inhibitors	20180301
US-2021038607-A1	Oxadiazolylthiophene derivatives useful as histone deacetylase inhibitors	20180301
EA-037208-B1	SUBSTITUTED PYRAZOLO [1,5-a] PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS	20170929

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Related Functional Groups

Azetidines

[1638761-21-3]
tert-butyl 3-ethyl-3-(hydroxymethyl)azetidine-1-carboxylate
[1638744-75-8]
tert-Butyl (2R,3R)-3-hydroxy-2-methylazetidine-1-carboxylate
[2126161-82-6]
Ethyl 3-methylazetidine-3-carboxylate hydrochloride
[1228230-92-9]
2-Azetidin-3-ylmethyl-pyridine trifluoroacetate
[17557-84-5]
3-Azetidinone hydrochloride
[741287-55-8]
(azetidin-3-ylmethyl)dimethylamine hydrochloride

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:	68.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.0763918
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	151.0763918
Rotatable Bond Count:	2
Topological Polar Surface Area:	21.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0