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Naphthalene, 1-(phenylmethoxy)-

HCID 136404
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Basic information

CAS
607-58-9
Standard SMILES
c1ccc(COc2cccc3ccccc23)cc1
InChIKey
JWSWULLEVAMIJK-UHFFFAOYSA-N
Molecular formula
C17H14O
Average molar mass
234.29 g/mol
Monoisotopic mass
234.10446507

Names & identifiers

Preferred name
Naphthalene, 1-(phenylmethoxy)-
IUPAC
1-phenylmethoxynaphthalene
English name
1-Benzyloxynaphthalene
Molecular formula
C17H14O
Molecular weight
234.29

Names & synonyms

607-58-9Naphthalene, 1-(phenylmethoxy)-1-(Phenylmethoxy)naphthaleneNSC 4044DTXSID80209514RefChem:831822DTXCID301320051-(Benzyloxy)naphthalene1-phenylmethoxynaphthaleneMFCD000783251-BENZYLOXYNAPHTHALENEEther, benzyl 1-naphthyl
Show more names
9-(benzyloxy)phenanthrene
Benzyl 1-naphthyl ether1-Naphthyl Benzyl EtherNSC4044benzyl naphthyl ethernaphthyl benzyl ether1-Naphtylbenzyl ether(1-Naphtyl)benzyl etherBenzyl alpha-naphthyl ether

Database identifiers

CAS
607-58-9
PubChem CID
136404
DTXSID
DTXSID80209514
EC Number
622-138-6
Nikkaji
J94.941H

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
244

Experimental & physicochemical properties

PolymersPolycyclic aromatic compound

Physicochemical properties

Melting point
73.5 · 73.5-74 °C
Boiling point
237 · 237-240 °C(Press: 13 Torr)
Density
1.125 · 1.125±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
solubility
Chloroform (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly)
form
Solid
color
Pale Orange to Light Orange
Symbol(GHS)
5 · GHS05,GHS07,GHS09
Signal word
Danger
Hazard statements
315 · H315-H318-H335-H410
Precautionary statements
261 · P261-P273-P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Peroxide Forming Chemical · 3 items

1-(Benzyloxy)naphthalene

D: Other compounds that may form peroxides

Kelly

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05,GHS07,GHS09
Hazard statements
H315-H318-H335-H410
Precautionary statements
P261-P273-P280-P305+P351+P338

Chemistry & industry

Applications

Uses1-Benzyloxynaphthalene is a naphthyl ether used in studies for the improvement of coal direct liquefaction by steam pretreatment.

Upstream & downstream products

Upstream raw materials

1-NaphtholBenzyl bromideCesium carbonate

Related reactions

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Compound notes

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