Articles:
2H,8H-benzo(1,2-b:5,4-b')dipyran-2-one, 5-methoxy-8,8-dimethyl-
Notes:
Isol. from Zanthoxylum americanum (prickly ash)
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| CAS Number: | 84-99-1 |  3D/inchi
|
| FDA UNII: | 69MPX4M5VD | |
| Nikkaji Web: | J9.335A | |
| XlogP3-AA: | 2.80 (est) | |
| Molecular Weight: | 258.27338000 | |
| Formula: | C15 H14 O4 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: toxic natural substances
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: | 133.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 438.60 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 387.00 °F. TCC ( 197.20 °C. ) (est) |
| logP (o/w): | 3.640 (est) |
| Soluble in: | |
| water, 40 mg/L @ 25 °C (exp) | |
| water, 35.21 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Xanthoxyletin 0.98
Odor: characteristic Use: Xanthoxyletin isolated from Zanthoxylum. |
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: | toxic natural substances | ||
| Recommendation for xanthoxyletin usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for xanthoxyletin flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 66548 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 5-methoxy-8,8-dimethyl-2H,8H-pyrano[3,2-g]chromen-2-one | |
| Chemidplus: | 0000084991 |
References:
| 5-methoxy-8,8-dimethyl-2H,8H-pyrano[3,2-g]chromen-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 66548 |
| Pubchem (sid): | 135024742 |
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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB33931 |
| FooDB: | FDB012133 |
| 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
| lemon root Search Trop Picture | |
| mandarin root Search Trop Picture | |
| orange root Search Trop Picture | |
| orange root bark Search Trop Picture | |
| zanthoxylum americanum Search Trop Picture |
Synonyms:
| 2H,8H- | benzo(1,2-b:5,4-b')dipyran-2-one, 5-methoxy-8,8-dimethyl- |
| 5- | methoxy-8,8-dimethyl-2H,8H-pyrano[3,2-g]chromen-2-one |
| 5- | methoxy-8,8-dimethyl-2H,8H-benzo(1,2-b:5,4-b')dipyran-2-one |
| 5- | methoxy-8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one |
| xanthoxylin N |