benzophenone
Suppliers  organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :diphenylmethanone
InChI :InChI=1/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey :RWCCWEUUXYIKHB-UHFFFAOYAX
SMILES :C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
cas number :119-61-9
(EINECS) number :204-337-6
beilstein number :1238185
fema number :2134
coe number :166
jecfa number :831
fl. number :07.032
molar refractivity :56.04 ± 0.3 cm3
parachor :426.9 ± 4.0 cm3
index of refraction :1.583 ± 0.02
surface tension :42.1 ± 3.0 dyne/cm
density :1.087 ± 0.06 g/cm3
polarizability :22.21 ± 0.5 10-24cm3
XlogP : 3.60
XlogP3 : 3.40
molecular weight : 182.2179000 (IUPAC)
formula :C13 H10 O
BioActivity Analysis :73790
pherobase floral:view
NMR Predictor :Predict
 
 
export tariff code :2914.39.90
fda reg :172.515
177.2600
Suppliers :
Berje :Benzophenone
Fleurchem :benzophenone
Inoue :BENZOPHENONE
John D. Walsh :Benzophenone
Moellhausen :benzophenone
99.5% min. nature identical kosher
Penta :benzophenone
Polarome :BENZOPHENONE
FCC
SAFC Global® :Benzophenone
≥99%, FCC, Kosher
Symrise :Benzophenone cryst.
Odor:  faint, sweet rose, light herbal nuance like geranium
Flavor:  slightly citrus, somewhat fruity.
Ungerer :Benzophenone
Vigon :Benzophenone Crystals
Odor:  Faint, sweet rose, light herbal nuance like geranium
organoleptics :
odor type :balsamic
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		balsam rose metallic powdery geranium
Luebke, William tgsc, (1981)
odor sample from :Ungerer & Company, Inc.
taste description:
apricot peach
substantivity :394 hour(s) at 100.00 %
properties :
appearence :white crystalline powder
assay : 99.00 to 100.00 %   
Food Chemicals Codex Listed :Yes
melting point : 47.00 to 51.00 °C. @ 760.00 mm Hg
boiling point : 305.00 to 307.00 °C. @ 760.00 mm Hg
boiling point : 170.00 to 171.00 °C. @ 15.00 mm Hg
congealing point :47.20 °C.
vapor density :6.3 ( Air = 1 )
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 3.18
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.
  R 36/37/38 - Irritating to eyes, respiratory system, and skin.
R 51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet.
Human experience : 6 % solution: non-sensitising.
Oral Toxicity(LD50) : 
  Oral-Rat    >10000.00  mg/kg
Food and Cosmetics Toxicology. Vol. 11, Pg. 873, 1973.

Oral-Mouse    2895.00  mg/kg
European Journal of Toxicology and Environmental Hygiene. Vol. 9, Pg. 99, 1976.

Intraperitoneal-Mouse    727.00  mg/kg
European Journal of Toxicology and Environmental Hygiene. Vol. 9, Pg. 99, 1976.

Dermal Toxicity(LD50) : 
  Skin-Rabbit  3535.00  mg/kg
Food and Cosmetics Toxicology. Vol. 11, Pg. 873, 1973.

Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU) :23.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :11.00 (μg/capita/day)
 
recommendation for benzophenone fragrance usage levels up to :
  6.0000 % in the fragrance concentrate.
recommendation for benzophenone flavor usage levels up to :
  2.0000 ppm in the flavor.
safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
msds :msds
EPI System :view
IUCLID :view
ClinicalTrials.gov :search
Daily Med :search
NIOSH International Chemical Safety Cards :search
NLM Hazardous Substances Data Bank :search
Chemical Carcinogenesis Research Information System :Search
Cancer Citations :Search
Toxicology Citations :Search
EPA GENetic TOXicology :Search
Env. Mutagen Info. Center :Search
NLM Developmental and Reproductive Toxicity :Search
National Toxicology Program :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 3077
 
WGK Germany :2
 
 
 
 
diphenylmethanone
(EINECS) number :204-337-6
RTECS :119-61-9
chemidplus :000119619
EPA/NOAA CAMEO :hazardous materials
EPA Substance Registry Services :119-61-9
dtp/nci :8077
references :
 
diphenylmethanone
fl. number :07.032
jecfa number :831
NIST Chemistry WebBook :1073705171
pubchem :151552
Cosmetics :
Cosmetic uses : masking agents
uv absorbers
other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
 C of A
RIFM :listed
FMA :listed
FDA Everything Added to Food in the United States (EAFUS)View
FDA Listing of Food Additive Status Part I (A through GView
FDA Listing of Food Additive Status Part II (H through ZView
Household Products : Search
synonyms :
 benzoyl benzene
 diphenyl ketone
alpha-oxodiphenyl methane
 diphenyl methanone
 diphenylmethanone
alpha-oxoditane
 phenyl ketone
soluble in :
 alcohol
 fixed oils
 paraffin oil
 water, 137 mg/L @ 25C
insoluble in :
 water
 glycerin
stability :
 bath foam
 non-discoloring in most media
 powder
 shampoo
potential blenders :    note
 acetanisoleFL/FR
 ambrette seed oilFL/FR
 ambroxanFL/FR
isoamyl benzoateFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
 amyris wood oilFL/FR
para-anisyl acetateFL/FR
 atractylis absoluteFR
 benzoin resinoidFL/FR
 benzyl cinnamateFL/FR
 benzyl salicylateFL/FR
 bois de rose oilFL/FR
isobornyl acetateFL/FR
isobutyl benzoateFL/FR
 camphor oilFL/FR
 carrot seed oilFL/FR
 cassia bark oilFL/FR
 cedarwood oils 
 chamomile oilFL/FR
 cistus oilFL/FR
 citronellolFL/FR
laevo-citronellolFL/FR
 citronellyl acetoneFL/FR
 costus valerolactoneFR
 decanalFL/FR
 decanolFL/FR
 dihydrorose oxideFR
 dimethyl benzyl carbinolFL/FR
 dodecanalFL/FR
 ethyl cinnamateFL/FR
 ethyl laurateFL/FR
 fir balsam absoluteFR
 floral pyranFR
 floral pyranolFR
 floral undecenoneFR
 frankincense oilFL/FR
 geraniolFL/FR
 geranium cyclohexaneFL/FR
 geranium nitrileFR
 geranium oilFL/FR
 geranium oil egyptFL/FR
 geranyl hexanoateFL/FR
 guaiacwood oilFL/FR
 gurjun balsam oilFR
 heliotropinFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hyacinth etherFR
 labdanum resinoidFR
 lilyallFR
laevo-linaloolFL/FR
 methyl cedryl ketoneFL/FR
 methyl ionones 
 musks 
beta-naphthyl ethyl etherFL/FR
 nerolidolFL/FR
gamma-nonalactoneFL/FR
 nonanolFL/FR
 ocean propanalFL/FR
 patchouli ethanoneFR
 peru balsam oilFL/FR
 phenethyl cinnamateFL/FR
 phenethyl phenyl acetateFL/FR
 phenyl acetaldehydeFL/FR
 rhodinyl propionateFL/FR
 rose absoluteFL/FR
 santallFR
 tonka bean absoluteFR
10-undecen-1-alFL/FR
 vanillinFL/FR
 verymossFR
 woody acetateFR
potential uses :
 agate
 amber
 apricot
 baby powder
 balsam
 bayberry
 berry
 bouquet
 butterscotch
 cedar forest
 christmas blends
 clean
 fir balsam
 fixer
 floral
 freesia
 fruit
 geranium
 ginger white ginger
 heather
 herbal
 hollyberry
 hyacinth jacinthe
 juniperberry
 lavender
 mimosa wattle
 moss
 muguet lily of the valley
 musk
 new car
 nut
 oriental
 patchouli
 peach
 pine
 pomegranate
 rain
 rose
 rose white rose
 sweet pea pois de senteur
 tea green tea
 tide
 vanilla
 woody
natural occurrence in :    note
 arisaema ciliatum S
 arisaema tortuosum S


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 03/10/2010