Articles:
acetic acid, 4-methoxyphenyl-
Notes:
4-Methoxyphenylacetic acid is a 4-O-Methylated catecholamine metabolite found in normal human urine, cerebrospinal fluid and brain tissue. (PMIDs 6511847, 4645252, 12416886) [HMDB]
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Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 13-23700 4-METHOXYPHENYLACETIC ACID
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| CAS Number: | 104-01-8 |  3D/inchi
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| ECHA EINECS - REACH Pre-Reg: | 203-166-4 | |
| FDA UNII: | AJP2V8U5K6 | |
| Nikkaji Web: | J10.116H | |
| Beilstein Number: | 1101737 | |
| MDL: | MFCD00004345 | |
| XlogP3: | 1.40 (est) | |
| Molecular Weight: | 166.17630000 | |
| Formula: | C9 H10 O3 | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: herbicides / pesticides
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: | 87.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 138.00 to 140.00 °C. @ 3.00 mm Hg |
| Boiling Point: | 306.00 to 307.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.000345 mmHg @ 25.00 °C. (est) |
| Flash Point: | 256.00 °F. TCC ( 124.30 °C. ) (est) |
| logP (o/w): | 1.420 |
| Soluble in: | |
| alcohol | |
| water, 9753 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| 4-Methoxyphenylacetic acid 99% |
| EMD Millipore |
| For experimental / research use only. |
| 4-Methoxyphenylacetic Acid |
| Penta International |
| 4-METHOXYPHENYLACETIC ACID |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 4-Methoxyphenylacetic Acid |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 4-ethoxyphenylacetic aAcid ReagentPlus®, 99% |
| TCI AMERICA |
| For experimental / research use only. |
| 4-Methoxyphenylacetic Acid >98.0%(GC)(T) |
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: | |
|
oral-rat LD50 1550 mg/kg Food and Cosmetics Toxicology. Vol. 14, Pg. 685, 1976. intraperitoneal-mouse LD50 504 mg/kg Journal of Medicinal Chemistry. Vol. 20, Pg. 709, 1977. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | herbicides / pesticides | ||
| Recommendation for 4-methoxyphenyl acetic acid usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 4-methoxyphenyl acetic 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 Substance Registry Services (TSCA): | 104-01-8 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 7690 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| 2-(4-methoxyphenyl)acetic acid | |
| Chemidplus: | 0000104018 |
| EPA/NOAA CAMEO: | hazardous materials |
| RTECS: | AI8960000 for cas# 104-01-8 |
References:
| 2-(4-methoxyphenyl)acetic acid | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 104-01-8 |
| Pubchem (cid): | 7690 |
| Pubchem (sid): | 134972571 |
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): | HMDB02072 |
| FooDB: | FDB022832 |
| Export Tariff Code: | 2918.29.7500 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| hedysarum coronarium Search Trop Picture | |
| ketaki flower oil india @ 0.50% Data GC Search Trop Picture | |
| plumeria rubra Search Trop Picture |
Synonyms:
| acetic acid, (p-methoxyphenyl)- | |
| acetic acid, 4-methoxyphenyl- | |
| acetic acid, p-methoxyphenyl- | |
| homo | anisic acid |
| homo-p- | anisic acid |
| 2-(p- | anisyl)acetic acid |
| 2-(para- | anisyl)acetic acid |
| benzeneacetic acid, 4-methoxy- | |
| 4- | methoxy phenylacetic acid |
| p- | methoxy-a-toluic acid |
| 4- | methoxy-benzeneacetic acid |
| (4- | methoxy-phenyl)-acetic acid |
| 4- | methoxybenzeneacetic acid |
| p- | methoxyphenyl-acetic acid |
| (4- | methoxyphenyl)acetic acid |
| (p- | methoxyphenyl)acetic acid |
| 2-(4- | methoxyphenyl)acetic acid |
| 4- | methoxyphenylacetic acid |
| p- | methoxyphenylacetic acid |
| 4- | methoxyphenylaceticacid |