hydroxymethyl isolongifolene 50% in dpg
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Notes :
Of wide potential application, from concentrates and toilet waters to fragrances for antiperspirants and deodorants. It is of particular value in woody types and has considerable potential in perfumes for men's toiletries. It is compatible with a wide range of perfumery compounding materials and has marked fixative properties.
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :octahydro-7,7,8,8-tetramethyl-2,3b-methano-3bH-cyclopenta(1,3)cyclopropa(1,2)benzene-4-methanol
InChI :InChI=1/C16H26O/c1-13(2)6-5-10(9-17)16-12-7-11(14(16,3)4)8-15(12,13)16/h10-12,17H,5-9H2,1-4H3
InChIKey :SJFICIAGRWSYBO-UHFFFAOYAH
SMILES :CC1(CCC(C23C14C2CC(C4)C3(C)C)CO)C
cas number :59056-64-3
% from :45.00% to 55.00%
(EINECS) number :261-580-0
molar refractivity :69.45 ± 0.4 cm3
parachor :548.9 ± 6.0 cm3
index of refraction :1.549 ± 0.03
surface tension :40.0 ± 5.0 dyne/cm
density :1.07 ± 0.1 g/cm3
polarizability :27.53 ± 0.5 10-24cm3
XlogP : 4.60
molecular weight : 234.3770400 (IUPAC)
formula :C16 H26 O
NMR Predictor :Predict
 
 
IUPAC name :(2S)-1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene-8-methanol
InChI :InChI=1/C16H26O/c1-14(2)7-5-11(10-17)13-15(3,4)12-6-8-16(13,14)9-12/h12,17H,5-10H2,1-4H3/t12-,16u/m0/s1
InChIKey :SQQNKCAPKQIRBP-HKALDPMFBC
SMILES :CC1(CCC(=C2C13CC[C@@H](C3)C2(C)C)CO)C
cas number :61826-53-7
(EINECS) number :263-251-7
molar refractivity :70.99 ± 0.4 cm3
parachor :566.3 ± 6.0 cm3
index of refraction :1.533 ± 0.03
surface tension :37.8 ± 5.0 dyne/cm
density :1.02 ± 0.1 g/cm3
polarizability :28.14 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 234.3770400 (IUPAC)
formula :C16 H26 O
NMR Predictor :Predict
 
 
IUPAC name :3-(3-hydroxypropoxy)propan-1-ol
InChI :InChI=1/C6H14O3/c7-3-1-5-9-6-2-4-8/h7-8H,1-6H2
InChIKey :SZXQTJUDPRGNJN-UHFFFAOYAD
SMILES :C(CO)COCCCO
cas number :25265-71-8
% from :55.00% to 45.00%
(EINECS) number :246-770-3
molar refractivity :35.66 ± 0.3 cm3
parachor :323.9 ± 4.0 cm3
index of refraction :1.450 ± 0.02
surface tension :39.8 ± 3.0 dyne/cm
density :1.040 ± 0.06 g/cm3
polarizability :13.74 ± 0.5 10-24cm3
XlogP : -0.70
molecular weight : 134.1735600 (IUPAC)
formula :C6 H14 O3
NMR Predictor :Predict
 
 
export tariff code :3302.90.0000
fda reg :unspecified
Suppliers :
John D. Walsh :Amborol 50
organoleptics :
odor type :amber
odor strength :medium
odor description¹ :
at 100.00 %.  		warm woody amber animal clary dry
odor sample from :Bush Boake Allen Inc
substantivity :208  Hour(s)
properties :
appearence :pale yellow clear liquid to crystals
assay : 45.00 to  55.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.01400 to 1.01800 @ 20.00 °C.
pounds per gallon - calc. : 8.447 to 8.481
refractive index :1.47100 to 1.47500 @ 20.00 °C.
acid value : 0.50  max.  KOH/g
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 4.56
safety :
most important hazard(s) :Xi - Irritant
  R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for hydroxymethyl isolongifolene 50% in dpg fragrance usage levels up to :
  10.0000 % in the fragrance concentrate.
recommendation for hydroxymethyl isolongifolene 50% in dpg flavor usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
octahydro-7,7,8,8-tetramethyl-2,3b-methano-3bH-cyclopenta(1,3)cyclopropa(1,2)benzene-4-methanol
(EINECS) number :261-580-0
chemidplus :059056643
EPA Substance Registry Services :59056-64-3
 
 
 
(2S)-1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene-8-methanol
(EINECS) number :263-251-7
chemidplus :061826537
EPA Substance Registry Services :61826-53-7
 
 
 
3-(3-hydroxypropoxy)propan-1-ol
(EINECS) number :246-770-3
RTECS :UB8765000 for cas# 25265-71-8
chemidplus :025265718
EPA Substance Registry Services :25265-71-8
references :
 
octahydro-7,7,8,8-tetramethyl-2,3b-methano-3bH-cyclopenta(1,3)cyclopropa(1,2)benzene-4-methanol
pubchem :678346
 
(2S)-1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene-8-methanol
pubchem :689962
 
3-(3-hydroxypropoxy)propan-1-ol
NIST Chemistry WebBook :64881945
pubchem :174790
Cosmetics :
Cosmetic uses : perfuming agents
other :
reference : Luebke, William tgsc, (1988)¹
CosIng :cosmetic data
synonyms :
 amborol
 hydroxymethyl isolongifolene 50% in dipropylene glycol
 hydroxymethyl isolongifolene 50% in dpg
 octahydro-7,7,8,8-tetramethyl-2,3b-methano-3bh-cyclopenta(1,3)cyclopropa(1,2)benzene-4-methanol
 octahydro-7,7,8,8-tetramethyl-2,3b-methano-3bH-cyclopenta(1,3)cyclopropa(1,2)benzene-4-methanol
 octahydrotetramethyl methanocyclopentacyclopropabenzene-4-methanol
soluble in :
 alcohol
insoluble in :
 water
stability :
 aerosols
 antiperspirant
 cream
 deodorants
 deodorants
 detergent
 fabric softener
 soap
 spray cologne
potential blenders :
 acetoxymethyl isolongifoleneFR
 acetyl cedreneFR
 amber acetateFR
 amber butanolFR
 amber caraneFR
 amber carbinolFR
 amber cyclohexanolFR
 amber dioxaneFR
 amber formateFR
 amber furanFR
 amber naphthofuranFL/FR
 amber oxepinFR
 amber pentadecaneFR
 ambrene acetalFR
 ambroxanFL/FR
 ambroxideFL/FR
 angelica seed oilFL/FR
 baby powder 
 bergamot mint oilFR
 boronia butenalFR
alpha-campholenic aldehydeFL/FR
alpha-cedrene epoxideFR
 cedrol methyl etherFR
 cedryl formateFR
 cedryl methyl etherFR
 champaca flower oilFL/FR
 clary acetateFR
 clary propyl acetateFR
 clary sage resinFL/FR
 costmary oilFL/FR
 dihydro-beta-iononeFL/FR
 elecampane root oilFL
 formoxymethyl isolongifoleneFR
 herbal careneFR
isolongifolene ketoneFR
 mcp acetate 
2-methoxy-4-vinyl phenolFL/FR
 methyl hydrogenated rosinateFR
 musk methyl ketoneFR
 ocimene oxiraneFR
 opoponax absoluteFL/FR
 opoponax resinoidFR
 patchouli woody amber 
 petitgrain oilFL/FR
 satinaldehydeFL/FR
 sclareolideFL/FR
 storax gumFL
 styrax oilFL/FR
 styrax resinoidFL
 tobacco dodecaneFR
 woody cyclohexanoneFR
 woody dioxolaneFR
 woody nonaneFR
 woody propanolFR
potential uses :
 amber
 ambergris
 balsam
 clary sage
 dry
 fixer
 musk
 woody
natural occurrence in :
 not found in nature  



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