Articles:
1-phenanthrenecarboxylic acid, 1,2,3,4,4a,5,6,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-
Notes:
Constit. of Pinus palustris (pitch pine)
| CAS Number: | 1945-53-5 |  3D/inchi
|
| FDA UNII: | A2QAG30V3T | |
| Nikkaji Web: | J12.734E | |
| XlogP3-AA: | 4.50 (est) | |
| Molecular Weight: | 302.45750000 | |
| Formula: | C20 H30 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: natural substances and extractives
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:
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 164.50 °C. @ 760.00 mm Hg |
| Boiling Point: | 440.20 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 407.00 °F. TCC ( 208.40 °C. ) (est) |
| logP (o/w): | 6.620 (est) |
| Soluble in: | |
| water, 0.01808 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Palustric Acid |
Safety Information:
| Preferred SDS: View | |
| 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: | natural substances and extractives | ||
| Recommendation for palustric acid usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for palustric acid 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 : | 443613 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid | |
| Chemidplus: | 0001945535 |
References:
| (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 1945-53-5 |
| Pubchem (cid): | 443613 |
| Pubchem (sid): | 134978933 |
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 |
| CHEBI: | View |
| KEGG (GenomeNet): | C12077 |
| HMDB (The Human Metabolome Database): | HMDB38172 |
| FooDB: | FDB017403 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| pine longleaf pine Search Trop Picture | |
| pinus nigra Search Trop Picture |
Synonyms:
| abieta-8,13-dien-18-oic acid | |
| 8,13- | abietadien-18-oic acid |
| (1theta-(1alpha,4abeta,10aalpha))-1,2,3,4,4a,5,6,9,10,10a- | decahydro-1,4a-dimethyl-7-(1-methyl ethyl)-1-phenanthrene carboxylic acid |
| [1R-(1a,4ab,10aa)]-1,2,3,4,4a,5,6,9,10,10a- | decahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid |
| (1R,4aS,10aR)-1,4a- | dimethyl-7-propan-2-yl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid |
| 1- | phenanthrenecarboxylic acid, 1,2,3,4,4a,5,6,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)- |
| podocarpa-8,13-dien-15-oic acid, 13-isopropyl- | |
| 13-iso | propyl podocarpa-8,13-dien-15-oic acid |
| 13-iso | propylpodocarpa-8,13-dien-15-oic acid |