Articles:
lup-20(29)-ene-3,28-diol, diacetate, (3beta)-
Notes:
None found
| CAS Number: | 1721-69-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 217-015-5 | |
| FDA UNII: | U2YW502S1Q | |
| Beilstein Number: | 2067908 | |
| MDL: | MFCD00017378 | |
| XlogP3-AA: | 9.40 (est) | |
| Molecular Weight: | 526.80118000 | |
| Formula: | C34 H54 O4 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: pharmaceuticals / chemical synthisis
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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | white fine powder (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 548.09 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 496.00 °F. TCC ( 258.00 °C. ) (est) |
| logP (o/w): | 10.489 (est) |
| Soluble in: | |
| water, 2.139e-006 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Carbosynth |
| For experimental / research use only. |
| Betulin Diacetate |
| ExtraSynthese |
| For experimental / research use only. |
| Betulin Diacetate (HPLC) ≥95% |
| Sigma-Aldrich |
| For experimental / research use only. |
| Betulin 3,28-diacetate |
| Skyherb Technologies |
| betulin diacetate |
Safety Information:
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | pharmaceuticals / chemical synthisis | ||
| Recommendation for betulin diacetate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for betulin diacetate flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 102155 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| [(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR)-9-acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopent[a]chrysen-3a-yl]methyl acetate | |
| Chemidplus: | 0001721693 |
References:
| [(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR)-9-acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopent[a]chrysen-3a-yl]methyl acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 102155 |
| Pubchem (sid): | 135255733 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (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 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| [(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR)-9- | acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopent[a]chrysen-3a-yl]methyl acetate |
| lup-20(29)-ene-3,28-diol, diacetate, (3b)- | |
| lup-20(29)-ene-3,28-diol, diacetate, (3beta)- |