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1,1-Diphenyl-2-propyn-1-ol

1,1-Diphenyl-2-propyn-1-ol - CAS 3923-52-2

Catalog:	BB023909
Product Name:	1,1-Diphenyl-2-propyn-1-ol
CAS:	3923-52-2
Synonyms:	1,1-diphenylprop-2-yn-1-ol

Technical Data

Safety and Hazards

Patents

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Computed Properties

IUPAC Name:	1,1-diphenylprop-2-yn-1-ol
Description:	1,1-Diphenyl-2-propyn-1-ol (CAS# 3923-52-2) is a useful research chemical.
Molecular Weight:	208.26
Molecular Formula:	C15H12O
Canonical SMILES:	C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI:	InChI=1S/C15H12O/c1-2-15(16,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h1,3-12,16H
InChI Key:	SMCLTAARQYTXLW-UHFFFAOYSA-N
Boiling Point:	179 °C (18 torr)
Purity:	> 97.0 % (GC)
Density:	1.131 g/cm³
Appearance:	Off-white powder
MDL:	MFCD00041570
LogP:	2.55570

Publication Number	Title	Priority Date
CN-112574421-A	Modified MQ resin and preparation method and application thereof	20201202
WO-2021134193-A1	An abrasion resistant multi-layered composite	20191230
WO-2021123315-A1	Method for the additive manufacturing of a silicone elastomer article	20191220
CN-110982077-A	Modified tackifier, preparation method and application	20191203
WO-2021102149-A1	Thermal interface materials and methods for application	20191119

PMID	Publication Date	Title	Journal
19901994	20091110	Potent new small-molecule inhibitor of botulinum neurotoxin serotype A endopeptidase developed by synthesis-based computer-aided molecular design	PloS one
18729354	20081006	Formation of a coordinated 2-aminoethylidene ligand and its rearrangement by deprotonation into a phosphinoallyl ligand containing a pyrrolidin-2-yl ring	Inorganic chemistry
16076226	20050810	Hydride-alkenylcarbyne to alkenylcarbene transformation in bisphosphine-osmium complexes	Journal of the American Chemical Society
15568082	20041207	[Ru(eta3-2-C3H4Me)(CO)(dppf)][SbF6]: a mononuclear 16e - ruthenium(II) catalyst for propargylic substitution and isomerization of HC[triple bond]CCPh2(OH)	Chemical communications (Cambridge, England)
15306900	20040821	A new class of tethered-arene ruthenium(II) complexes with pendant P and C donor atoms: synthesis of eta6:eta1:eta1 phosphonio-azabutadienyl ruthenabicycles via allenylidene intermediates	Chemical communications (Cambridge, England)

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	242
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.088815002
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	208.088815002
Rotatable Bond Count:	3
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8