Articles:
1,2,3-butanetricarboxylic acid, 3-hydroxy-
Notes:
None found
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| CAS Number: | 6061-95-6 |  3D/inchi
|
| FDA UNII: | 8518EC1Z2E | |
| XlogP3-AA: | -1.60 (est) | |
| Molecular Weight: | 206.15110000 | |
| Formula: | C7 H10 O7 | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: information only not used for fragrances or flavors
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 |
| Boiling Point: | 330.98 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 335.00 °F. TCC ( 168.20 °C. ) (est) |
| logP (o/w): | -0.993 (est) |
| Soluble in: | |
| water, 1e+006 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. |
| 3-hydroxybutane-1,2,3-tricarboxylic acid |
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: | information only not used for fragrances or flavors | ||
| Recommendation for threo-alpha-methyl isocitrate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for threo-alpha-methyl isocitrate 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 : | 513 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3-hydroxybutane-1,2,3-tricarboxylic acid | |
| Chemidplus: | 0006061956 |
References:
| 3-hydroxybutane-1,2,3-tricarboxylic acid | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 513 |
| Pubchem (sid): | 135229097 |
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): | HMDB06471 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 1,2,3- | butanetricarboxylic acid, 3-hydroxy- |
| 3- | carboxy-2,3-dideoxy-4-C-methylpentaric acid |
| 3- | hydroxy-1,2,3-butane tricarboxylate |
| 3- | hydroxy-1,2,3-butanetricarboxylate |
| 3- | hydroxybutane-1,2,3-tricarboxylic acid |
| alpha- | methylisocitrate |
| DL-threo-alpha- | methylisocitrate |
| threo-alpha- | methylisocitrate |