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1,3-Diphenyl-2-propyn-1-ol

1,3-Diphenyl-2-propyn-1-ol - CAS 1817-49-8

Catalog:	BB013828
Product Name:	1,3-Diphenyl-2-propyn-1-ol
CAS:	1817-49-8
Synonyms:	1,3-diphenylprop-2-yn-1-ol

Technical Data

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Computed Properties

IUPAC Name:	1,3-diphenylprop-2-yn-1-ol
Description:	1,3-Diphenyl-2-propyn-1-ol (CAS# 1817-49-8 ) is a useful research chemical.
Molecular Weight:	208.26
Molecular Formula:	C15H12O
Canonical SMILES:	C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)O
InChI:	InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10,15-16H
InChI Key:	DZZWMODRWHHWFR-UHFFFAOYSA-N
Boiling Point:	364.7 °C at 760 mmHg
Density:	1.14 g/cm³
Appearance:	Colorless to yellow liquid
MDL:	MFCD06654198
LogP:	2.77170

Publication Number	Title	Priority Date
CN-113461501-A	Green method for high-selectivity synthesis of chalcone compounds	20210705
CN-113024553-A	Triazolo tetrahydro-beta-carboline derivative and preparation method and application thereof	20210316
CN-112264105-A	Supported palladium catalyst for synthesis of substituted ketone and bisphenol F	20201117
CN-111974456-A	Copper catalyst for propargyl alcohol rearrangement and preparation method thereof	20200828
US-2021054003-A1	Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use	20190820

PMID	Publication Date	Title	Journal
21336396	20110407	Electrophilic chemistry of propargylic alcohols in imidazolium ionic liquids: propargylation of arenes and synthesis of propargylic ethers catalyzed by metallic triflates [Bi(OTf)3, Sc(OTf)3, Yb(OTf)3], TfOH, or B(C6F5)3	Organic & biomolecular chemistry

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GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Complexity:	258
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:	2
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1