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6-Amino-3-oxabicyclo[3.1.0]hexane Hydrochloride

6-Amino-3-oxabicyclo[3.1.0]hexane Hydrochloride - CAS 693248-55-4

Catalog:	BB033777
Product Name:	6-Amino-3-oxabicyclo[3.1.0]hexane Hydrochloride
CAS:	693248-55-4
Synonyms:	3-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride; 3-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride
Description:	6-Amino-3-oxabicyclo[3.1.0]hexane Hydrochloride (CAS# 693248-55-4 ) is a useful research chemical.
Molecular Weight:	135.59
Molecular Formula:	C5H10ClNO
Canonical SMILES:	C1C2C(C2N)CO1.Cl
InChI:	InChI=1S/C5H9NO.ClH/c6-5-3-1-7-2-4(3)5;/h3-5H,1-2,6H2;1H
InChI Key:	JCFIYVURKHIYFF-UHFFFAOYSA-N
LogP:	1.09220

Publication Number	Title	Priority Date
AU-2018352699-A1	Pyrimidine TBK/IKKE inhibitor compounds and uses thereof	20171017
CA-3078579-A1	Pyrimidine tbk/ikk.epsilon. inhibitor compounds and uses thereof	20171017
WO-2019079373-A1	PYRIMIDINE TBK / IKKÎµ INHIBITORY COMPOUNDS AND USES THEREOF	20171017
EP-3697772-A1	Pyrimidine tbk/ikk inhibitor compounds and uses thereof	20171017
AU-2017245641-A1	Pyridyl derivatives as bromodomain inhibitors	20160407

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): 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:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	84.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.0450916
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	135.0450916
Rotatable Bond Count:	0
Topological Polar Surface Area:	35.2
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0