2-Adamantylamine hydrochloride - CAS 10523-68-9

Name: 2-Adamantylamine hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB001585
Product Name:	2-Adamantylamine hydrochloride
CAS:	10523-68-9
Synonyms:	adamantan-2-amine;hydrochloride

Technical Data

IUPAC Name:	adamantan-2-amine;hydrochloride
Description:	2-Adamantanamine Hydrochloride can be used to prepare CD73 inhibitors to treat CD73-associated diseases, including cancer and immune-related disorders.
Molecular Weight:	187.71
Molecular Formula:	C10H17N · HCl
Canonical SMILES:	C1C2CC3CC1CC(C2)C3N.Cl
InChI:	InChI=1S/C10H17N.ClH/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;/h6-10H,1-5,11H2;1H
InChI Key:	WLDWDRZITJEWRJ-UHFFFAOYSA-N
Boiling Point:	226.1 °C at 760 mmHg
Melting Point:	300 °C
Purity:	> 99.0 % (T)
Appearance:	Solid
Storage:	Store in a cool, dry place. Store in a tightly closed container.
MDL:	MFCD00074743
LogP:	3.27210

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

Publication Number	Title	Priority Date
WO-2020213008-A1	Small-molecular adjuvants and implementations thereof	20190415
WO-2020103856-A1	Mmpl3 inhibitors, compositions and uses thereof	20181120
US-2020131431-A1	Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors	20181026
WO-2020086309-A1	Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors	20181026
US-2020078388-A1	Cd73 inhibitors and pharmaceutical uses thereof	20180911

PMID	Publication Date	Title	Journal
18947998	20081201	Comparisons of the influenza virus A M2 channel binding affinities, anti-influenza virus potencies and NMDA antagonistic activities of 2-alkyl-2-aminoadamantanes and analogues	Bioorganic & medicinal chemistry letters
16161183	20060501	Simultaneous liquid chromatographic assay of amantadine and its four related compounds in phosphate-buffered saline using 4-fluoro-7-nitro-2,1,3-benzoxadiazole as a fluorescent derivatization reagent	Biomedical chromatography : BMC
15856951	20050301	[DNA macroarray analysis of gene expression changes in rat brain after single administration of 2-aminoadamantane compound]	Molekuliarnaia biologiia
14670755	20040125	Liquid chromatographic determination of 1-adamantanamine and 2-adamantanamine in human plasma after pre-column derivatization with o-phthalaldehyde and 1-thio-beta-D-glucose	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences

Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.1127773
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	187.1127773
Rotatable Bond Count:	0
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0