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3-(1-Naphthyl)-2-propyn-1-ol

3-(1-Naphthyl)-2-propyn-1-ol - CAS 16176-22-0

Catalog:	BB011777
Product Name:	3-(1-Naphthyl)-2-propyn-1-ol
CAS:	16176-22-0
Synonyms:	3-naphthalen-1-ylprop-2-yn-1-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	3-naphthalen-1-ylprop-2-yn-1-ol
Description:	3-(1-Naphthyl)-2-propyn-1-ol (CAS# 16176-22-0 ) is a useful research chemical.
Molecular Weight:	182.22
Molecular Formula:	C13H10O
Canonical SMILES:	C1=CC=C2C(=C1)C=CC=C2C#CCO
InChI:	InChI=1S/C13H10O/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-3,5-7,9,14H,10H2
InChI Key:	FARRJNMECLDKPD-UHFFFAOYSA-N
Boiling Point:	356.3 °C at 760 mmHg
Density:	1.18 g/cm³
Appearance:	White to brown crystal to powder
MDL:	MFCD09265172
LogP:	2.18360

Publication Number	Title	Priority Date
WO-2020223672-A1	Functionalized cyclic polymers and methods of preparing same	20190501
US-2011105544-A1	Carboxylic derivatives for use in the treatment of cancer	20071221
WO-2009080722-A2	Carboxylic derivatives for use in the treatment of cancer	20071221
BR-PI0718654-A2	COMPOSITION, PHARMACEUTICAL COMPOSITION, ENANCIOMER, NEUROBIOLOGICALLY ACTIVE COMPOSITION, AND METHODS FOR TREATMENT OR PREVENTION OF A CENTRAL NERVOUS SYSTEM DISORDER IN A MAMMALIAN PATIENT AND FOR THE MANUFACTURE OF A COMPOSITION.	20061107
CA-2705457-A1	Novel arylbicyclo[3.1.0]hexylamines and methods and compositions for their preparation and use	20061107

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Complexity:	245
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	182.073164938
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	182.073164938
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3