3,3-Dimethyl-4-piperidone Hydrochloride - CAS 648921-37-3

Catalog:	BB032587
Product Name:	3,3-Dimethyl-4-piperidone Hydrochloride
CAS:	648921-37-3
Synonyms:	3,3-dimethyl-4-piperidinone;hydrochloride; 3,3-dimethylpiperidin-4-one;hydrochloride

Technical Data

Patents

Computed Properties

IUPAC Name:	3,3-dimethylpiperidin-4-one;hydrochloride
Description:	3,3-Dimethyl-4-piperidone Hydrochloride (CAS# 648921-37-3) is a useful research chemical.
Molecular Weight:	163.65
Molecular Formula:	C7H14ClNO
Canonical SMILES:	CC1(CNCCC1=O)C.Cl
InChI:	InChI=1S/C7H13NO.ClH/c1-7(2)5-8-4-3-6(7)9;/h8H,3-5H2,1-2H3;1H
InChI Key:	YKKXZGNFWDQKGO-UHFFFAOYSA-N
LogP:	1.70580

Publication Number	Title	Priority Date
WO-2018136887-A1	Compounds	20170123
AU-2013370977-A1	Heterobicyclo-substituted-[1,2,4]triazolo[1,5-c]quinazolin-5-amine compounds with A2A antagonist properties	20121228
AU-2013370977-B2	Heterobicyclo-substituted-[1,2,4]triazolo[1,5-c]quinazolin-5-amine compounds with A2A antagonist properties	20121228
CA-2896056-A1	Heterobicyclo-substituted-[1,2,4]triazolo[1,5-c]quinazolin-5-amine compounds with a2a antagonist properties	20121228
DK-2945632-T3	HETEROBICYCLO SUBSTITUTED - [1,2,4] TRIAZOL [1,5-C] QUINAZOLIN-5-AMINE COMPOUNDS SUITABLE FOR TREATMENT OR PREVENTION OF DISORDERS IN CENTRAL NERVOUS SYSTEM	20121228

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Related Functional Groups

Piperidones

[1454-53-1]
Ethyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride
[518990-24-4]
Ethyl 2-Oxo-2-(1-Boc-4-oxo-3-piperidyl)acetate
[1525448-33-2]
1-Boc-2,2-dimethyl-3-piperidinone
[1303968-37-7]
2,2-Dimethyl-4-piperidone Hydrochloride
[1267039-62-2]
3-(2-Chlorophenyl)-2-piperidone
[87922-74-5]
5-[4-(Trifluoromethyl)phenyl]-2-piperidone

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Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	163.0763918
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	163.0763918
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0