diphenyl oxide
 
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IUPAC name :phenoxybenzene
InChI :InChI=1/C12H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H
InChIKey :USIUVYZYUHIAEV-UHFFFAOYAV
SMILES :C1=CC=C(C=C1)OC2=CC=CC=C2
(EINECS) number :202-981-2
cas number :101-84-8
beilstein number :1364620
fema number :3667
coe number :2201
jecfa number :1255
fl. number :04.035
molar refractivity :52.69 ± 0.3 cm3
parachor :398.3 ± 4.0 cm3
index of refraction :1.572 ± 0.02
surface tension :38.4 ± 3.0 dyne/cm
density :1.063 ± 0.06 g/cm3
polarizability :20.89 ± 0.5 10-24cm3
xlogp : 3.50
molecular weight : 170.2072000
formula :C12 H10 O
BioActivity Analysis :48415039
 
 
fda reg :unspecified h. number :2909.30.0000
organoleptics : 
odor type :green
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
geranium leaf green phenolic
substantivity :156  Hour(s)
properties : 
appearence :colorless solid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.06500 - 1.07300 @ 30.00 °C.
pounds per gallon - calc. : 8.862 to 8.928
refractive index :1.58000 - 1.58100 @ 20.00 °C.
melting point : 27.00 - 30.00 °C. @ 760.00 mm Hg
boiling point : 258.00 - 259.00 °C. @ 760.00 mm Hg
logp : 4.21
shelf life : 36.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.
safety : 
most important hazard(s) : Xi N - Irritant, Dangerous for the environment.
  
Oral Toxicity(LD50) : Oral-Rat    2450.00  mg/kg  NTIS**  0TS0518143
Dermal Toxicity(LD50) : Skin-Rabbit  >7940.00  mg/kg  NTIS**  0TS0518143
  
flash point ( Deg. F. ) : 240.00  °F.  TCC  ( 115.56 °C. )
  
recommendation for diphenyl oxide usage levels up to :
  1.0000 % in the fragrance concentrate.
  
safety links : 
msds :msds
  
(EINECS) number :202-981-2
rtecs :KN8970000 for 101-84-8
chemidplus :000101848
epa-srs :101-84-8
dtp/nci :19311
  
other : 
  C of A
references : 
pubchem :150663
NIST Chemistry WebBook :690318354
  
synonyms :
1,1'-oxybisbenzene
oxybisbenzene
 biphenyl oxide
oxydiphenyl
 diphenyl ether
 diphenyl oxide
 geranium crystals
 phenoxybenzene
 phenyl ether
 phenyl oxide
soluble in :
 alcohol
 kerosene
 paraffin oil
 water, 18 mg/L @ 25C
insoluble in :
 water
stability :
 non-discoloring
(odor and/or flavor) blends with :
 abies sibirica oil
 acetaldehyde ethyl phenethyl acetal
 acetophenone
 algae absolute
 allyl amyl glycolate
isoamyl benzoate
alpha-amyl cinnamaldehyde
isoamyl salicylate
 amyris wood oil
para-anisyl alcohol
 benzophenone
 benzyl acetate
 benzyl alcohol
 benzyl salicylate
 benzylidene acetone
 bois de rose oil
isobutyl quinoline
isobutyl salicylate
 caraway seed oil
 carrot seed oil
 cinnamyl alcohol
 citral
 citronellol
 citrus carbaldehyde
 clary sage oil
 cortex pyridine
para-cresyl caprylate
 cuminaldehyde
 cyclamen aldehyde
(E)-4-decen-1-al
 dimethyl benzyl carbinol
 dimethyl hydroquinone
 dodecanal
 dodecanol
 ethyl cinnamate
 ethyl laurate
 fir balsam absolute
 floral pyranol
 galbanum oil
 geraniol
 geranium oil
 geranyl acetate
 green acetate
 hay absolute
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 hyacinth ether
 ionones
 leaf acetal
laevo-linalool
 linalool oxide
 melon nonenoate
 methyl dihydrojasmonate
 methyl heptine carbonate
 methyl octine carbonate
 mimosa absolute
 narcissus absolute
 nerol
(E,Z)-2,6-nonadien-1-ol
 nonanol
 oakmoss absolute
 ocean propanal
 orris pyridine
 patchouli ethanone
 phenethyl alcohol
 phenethyl phenyl acetate
 phenethyl salicylate
 phenyl acetaldehyde
 phenyl acetaldehyde dimethyl acetal
3-phenyl propionaldehyde
 rhodinol
 rose oxides
 santall
alpha-terpineol
 tetrahydrolinalool
 tonka bean absolute
 tricyclodecenyl acetate
 vanilla absolute
 verymoss
 violet methyl carbonate
 woody amylene
(odor and/or flavor) used in :
 agrumen
 algae
 amaryllis
 amber
 ambrosia
 ash mountain ash
 bark
 bayberry
 blackberry
 bluebell
 boronia
 bouquet
 boxwood
 boxwood blossom
 boxwoodberry
 calyx
 carrot seed
 cassis black currant bud
 celery
 chamomile
 champaca champak
 chervil
 chrysanthemum chrysantheme
 cilantro
 citronella
 citrus
 clematis
 clover trefle le'trefle incarnat
 cortex
 cranberry
 cypress
 daffodil narcissus
 davana
 earth humus
 erica
 evergreen
 fern fougere
 fig
 fir balsam
 fixer
 floral
 flouve blossom
 foliage
 forest pine forest
 fresh
 fungus
 geranium
 ginger white ginger
 gooseberry
 green
 hay new mown hay foin coupe
 herbal
 hollyberry
 hyacinth jacinthe
 hydrangea
 ivy leaf
 jonquil narcissus jonquilla
 kewda
 leaf
 lemon
 lily
 lotus
 marjoram
 mimosa wattle
 mint
 moss
 muguet lily of the valley
 narcissus narcisse
 ocean sea
 orchid
 palmarosa
 pansy
 parsley
 peach
 pear prickly pear
 pennyroyal
 peppermint
 privet
 privet blossom
 reseda mignonette
 rose
 rose geranium
 rose tea rose
 sassafras
 seaweed
 stem
 stephanotis
 sweet pea pois de senteur
 tea
 valerian
 vine
 weedy
 wintergreen
 yew
natural occurrence in :
not found in nature



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