Articles:
| None found yet. |
Notes:
sandalwood enhancer - santall and heliotropin.
cloth accord - musk gx, alcohol C-12, lilyall and santall.
| Fragrance Demo Formulas | ||
| 4-(1,7,7-trimethyl-2-bicyclo[3.1.1]heptanyl)cyclohexan-1-ol (Click)
IUPAC Name: 4-(1,7,7-trimethyl-2-bicyclo[3.1.1]heptanyl)cyclohexan-1-ol
Std.InChI: InChI=1S/C16H28O/c1-15(2)12-6-9-14(16(15,3)10-12)11-4-7-13(17)8-5-11/h11-14,17H,4-10H2,1-3H3
InChI: InChI=1/C16H28O/c1-15(2)12-6-9-14(16(15,3)10-12)11-4-7-13(17)8-5-11/h11-14,17H,4-10H2,1-3H3
Std.InChIKey: DYAWFJGTISRTFV-UHFFFAOYSA-N
InChIKey: DYAWFJGTISRTFV-UHFFFAOYAD
SMILES: CC1(C2CCC(C1(C2)C)C3CCC(CC3)O)C
| ||
| CAS Number: | 68877-29-2 | 
|
| Other: | 688772-29-2 | |
| ECHA EINECS - REACH Pre-Reg: | 272-556-4 | |
| CoE Number: | 755 | |
| XlogP3-AA: | 4.60 (est) | |
| Molecular Weight: | 236.39836000 | |
| Formula: | C16 H28 O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
Physical Properties:
| Appearance: | colorless to pale yellow clear very viscous liquid to solid (est) |
| Assay: | 98.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.97000 to 0.99500 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 8.071 to 8.279 |
| Refractive Index: | 1.49000 to 1.51000 @ 20.00 °C. |
| Flash Point: | 334.00 °F. TCC ( 168.00 °C. ) |
| logP (o/w): | 5.640 |
| 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. |
| Soluble in: | |
| amyris wood oil | |
| isopropyl myristate | |
| paraffin oil | |
| water, 1.693 mg/L @ 25 °C (est) | |
| Stability: | |
| antiperspirant | |
| detergent | |
| fabric softener | |
| hair spray | |
| soap | |
Organoleptic Properties:
| Odor Type: | woody |
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | woody clean sandalwood balsam |
| Substantivity: | 400 Hour(s) |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
masking agents perfuming agents solvents |
Safety Information:
| Most important hazard(s): | |
| Xi - Irritant | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | fragrance agents | ||
| Recommendation for santall 100% usage levels up to: | |||
| 10.0000 % in the fragrance concentrate. | |||
| Recommendation for santall 100% flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 68877-29-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 111394 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 4-(1,7,7-trimethyl-2-bicyclo[3.1.1]heptanyl)cyclohexan-1-ol | |
| Chemidplus: | 0068877292 |
References:
| Leffingwell: | Chirality or Article |
| 4-(1,7,7-trimethyl-2-bicyclo[3.1.1]heptanyl)cyclohexan-1-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 68877-29-2 |
| Pubchem (cid): | 111394 |
| Pubchem (sid): | 135067711 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2009 |
| (IUPAC): | Atomic Weights of the Elements 2009 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 3302.90.9090 |
| ChemSpider: | View |
| Wikipedia: | View |
| RSC Learn Chemistry: | View |
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| iso | bornyl cyclo hexenol |
| bornyl cyclohexanol | |
| iso | bornyl cyclohexanol |
| camphyl cyclohexanol | |
| candalum rhodiantal | |
| cyclohexanol, (1,7,7-trimethylbicyclo(2.2.1)hept-2-yl)- | |
| polarsan | |
| santalex (Takasago) | |
| santalex T (Takasago) | |
| santalex T neat (Takasago) | |
| santalex-neat | |
| santall | |
| santall 80% ipm | |
| (1,7,7- | trimethyl bicyclo(2.2.1)hept-2-yl) cyclohexan-1-ol |
| (1,7,7- | trimethyl bicyclo(2.2.1)hept-2-yl) cyclohexanol |
| 1,7,7- | trimethyl bicyclohept-2-yl cyclohexanol |
| 4-(1,7,7- | trimethyl-2-bicyclo[3.1.1]heptanyl)cyclohexan-1-ol |