Allyl phenyl ether

Inquiry

Molecular Formula:

C9H10O

Molecular Weight:

134.18

CAS Number:

1746-13-0

Catalog Number:

1746-13-0

Product Information

Molecular Formula:

C9H10O

Molecular Weight:

134.18

Description

Allyl phenyl ether (CAS# 1746-13-0 ) is a useful research chemical.

Synonyms

(2-propenyloxy)-benzen; (prop-2-enyloxy)-benzene; 3-Phenoxypropene; Allyl phenoxylate; Ether, allyl phenyl; ether, allylphenyl; Phenyl 2-propenyl ether; Phenylpropenyl ether

IUPAC Name

prop-2-enoxybenzene

Canonical SMILES

C=CCOC1=CC=CC=C1

InChI

InChI=1S/C9H10O/c1-2-8-10-9-6-4-3-5-7-9/h2-7H,1,8H2

InChI Key

POSICDHOUBKJKP-UHFFFAOYSA-N

Boiling Point

192.4±9.0 °C at 760 mmHg

Flash Point

62 °C

Purity

> 95.0 % (GC)

Density

0.9±0.1 g/cm³

Appearance

Clear colorless to yellow liquid

Refractive Index

n20/D 1.522 (lit.)

Safety Information

Hazards

H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.

Precautionary Statement

P261:
Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352+P312:
IF ON SKIN:
Wash with plenty of soap and water.
Call a POISON CENTER or doctor/physician if you feel unwell.
P304+P340+P312:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Call a POISON CENTER or doctor/physician if you feel unwell.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.

Computed Properties

XLogP3

2.9

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

134.073164938 g/mol

Monoisotopic Mass

134.073164938 g/mol

Topological Polar Surface Area

9.2Å²

Heavy Atom Count

Formal Charge

Complexity

92.9

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-113861683-A	High-thermal-conductivity ultrahigh-temperature-resistant encapsulating insulating material and preparation method thereof	2021-11-01
CN-113773166-A	Olefin isomerization method	2021-08-31
CN-113234243-A	Preparation method of cellulose-based self-reinforced material	2021-05-08
CN-113024776-A	Heat-sensitive epoxy curing agent, preparation method thereof and epoxy resin composition	2021-04-07
CN-112500524-A	Anhydride group modified acrylate resin curing agent, preparation method and application	2020-12-28
CN-112500525-A	Water-and oil-repellent anhydride group fluorine-containing acrylate resin, preparation method and application	2020-12-28
CN-112625553-A	Latent self-curing resin coating composition and construction method thereof	2020-12-28
CN-112500524-B	Anhydride group modified acrylate resin curing agent, preparation method and application	2020-12-28
CN-112625553-B	Latent self-curing resin coating composition and construction method thereof	2020-12-28
CN-112299981-A	Preparation method of alpha, alpha-difluoroketone derivative	2020-10-29

Literatures

PMID	Publication Date	Title	Journal
22692395	2012-07-21	Photo-impulsive reactions in the electronic ground state without electronic excitation: non-photo, non-thermal chemical reactions	Physical chemistry chemical physics : PCCP
22482800	2012-05-16	The phenoxyl radical-water complex--a matrix isolation and computational study	Journal of the American Chemical Society
19950911	2010-01-01	Pd-catalyzed synthesis of allylic silanes from allylic ethers	Organic letters
18712927	2008-09-19	Synthesis of unsymmetrical benzil licoagrodione	The Journal of organic chemistry
18491853	2008-06-12	A theoretical study of pericyclic rearrangements catalyzed by lithium	The journal of physical chemistry. A
14695556	2004-01-05	Zirconium-mediated coupling reactions of amines and enol or allyl ethers: synthesis of allyl- and homoallylamines	Chemistry (Weinheim an der Bergstrasse, Germany)
14572255	2003-10-30	SmI2/water/amine mediates cleavage of allyl ether protected alcohols: application in carbohydrate synthesis and mechanistic considerations	Organic letters
11599953	2001-10-22	Facile allylic C-H bond activation on the bridging disulfide ligand in the Ru(III) dinuclear complex having a conjugated RuSSRu core	Inorganic chemistry
11463320	2001-07-26	LiCB(11)Me(12): a catalyst for pericyclic rearrangements	Organic letters

The molarity calculator equation

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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