N-(2-Propynyl)-2,3-dihydroinden-1-amine - CAS 1875-50-9

Catalog:	BB014429
Product Name:	N-(2-Propynyl)-2,3-dihydroinden-1-amine
CAS:	1875-50-9
Synonyms:	N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine; N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine
Description:	N-(2-Propynyl)-2,3-dihydroinden-1-amine (CAS# 1875-50-9) is a reagent used in the preparation of anti-inflammatory 1-amino-indane derivatives.
Molecular Weight:	171.24
Molecular Formula:	C12H13N
Canonical SMILES:	C#CCNC1CCC2=CC=CC=C12
InChI:	InChI=1S/C12H13N/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12/h1,3-6,12-13H,7-9H2
InChI Key:	RUOKEQAAGRXIBM-UHFFFAOYSA-N
Boiling Point:	305.5 °C at 760 mmHg
Density:	1.05 g/cm³
LogP:	2.63520

Publication Number	Title	Priority Date
WO-2020229968-A1	Non-lysosomal glucosylceramidase inhibitors and uses thereof	20190510
EP-3712128-A1	Photochemical intermolecular amination method	20190318
CN-111333517-A	Improved method for preparing rasagiline	20181219
WO-2020047368-A1	Methods of treating or preventing amyotrophic lateral sclerosis	20180830
CN-112673107-A	Methods of treating or preventing amyotrophic lateral sclerosis	20180830

PMID	Publication Date	Title	Journal
28962525	20171001	From the Cover: Manganese and Rotenone-Induced Oxidative Stress Signatures Differ in iPSC-Derived Human Dopamine Neurons	Toxicological sciences : an official journal of the Society of Toxicology
22954444	20121115	Comparison of the cutaneous iontophoretic delivery of rasagiline and selegiline across porcine and human skin in vitro	International journal of pharmaceutics
22834567	20120901	Rasagiline: a guide to its use in Parkinson's disease	CNS drugs
22547660	20120801	Proteoliposome-based capillary electrophoresis for screening membrane protein inhibitors	Journal of chromatographic science
22304415	20120701	Indirect comparisons of adverse events and dropout rates in early Parkinson's disease trials of pramipexole, ropinirole, and rasagiline	The International journal of neuroscience

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Related Functional Groups

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Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.104799419
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.104799419
Rotatable Bond Count:	2
Topological Polar Surface Area:	12
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8