Articles:
2-propenal, 2-bromo-3-phenyl-, (Z)-
Notes:
anti-mildew agent.
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| CAS Number: | 5443-49-2 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 226-637-6 | |
| Nikkaji Web: | J60.277I | |
| Beilstein Number: | 1099733 | |
| MDL: | MFCD00006965 | |
| XlogP3-AA: | 2.70 (est) | |
| Molecular Weight: | 211.05799000 | |
| Formula: | C9 H7 Br O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: cosmetic agents
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: | 304.44 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.001000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 230.00 °F. TCC ( 110.20 °C. ) (est) |
| logP (o/w): | 2.491 (est) |
| Soluble in: | |
| water, 496 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
fragrance |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| a-Bromocinnamaldehyde >98.0%(T) |
| Carbosynth |
| For experimental / research use only. |
| 2-Bromocinnamaldehyde |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| a-Bromocinnamaldehyde>98.0%(gc) |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| a-Bromocinnamaldehyde 98% |
| TCI AMERICA |
| For experimental / research use only. |
| a-Bromocinnamaldehyde>98.0%(GC) |
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: | |
|
intraperitoneal-mouse LD50 822 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969. oral-mouse LD50 470 mg/kg SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" BEHAVIORAL: ATAXIA Science Reports of the Research Institutes, Tohoku University, Series C: Medicine. Vol. 36(1-4), Pg. 10, 1989. intraperitoneal-rat LD50 513 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969. oral-rat LD50 1450 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969. | |
| Dermal Toxicity: | |
|
subcutaneous-mouse LD50 2200 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969. subcutaneous-rat LD50 1210 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 11, Pg. 919, 1969. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | cosmetic agents | ||
| Recommendation for bromocinnamal usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for bromocinnamal flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| Chemical Carcinogenesis Research Information System: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5369403 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| (Z)-2-bromo-3-phenylprop-2-enal | |
| Chemidplus: | 0005443492 |
| RTECS: | GD6480000 for cas# 5443-49-2 |
References:
| (Z)-2-bromo-3-phenylprop-2-enal | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 5369403 |
| Pubchem (sid): | 134985610 |
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 |
| Export Tariff Code: | 2913.00.4000 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| additives |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| alphabrocine | |
| (2Z)-2- | bromo-3-phenyl-2-propenal |
| (Z)-2- | bromo-3-phenyl-2-propenal |
| 2- | bromo-3-phenyl-2-propenal |
| (2Z)-2- | bromo-3-phenylacrylaldehyde |
| (Z)-2- | bromo-3-phenylacrylaldehyde |
| 2- | bromo-3-phenylacrylaldehyde |
| (2Z)-2- | bromo-3-phenylprop-2-enal |
| (Z)-2- | bromo-3-phenylprop-2-enal |
| a- | bromocinnamaldehyde |
| alpha- | bromocinnamaldehyde |
| a- | bromocinnamic aldehyde |
| cinnamaldehyde, a-bromo- | |
| 2- | propenal, 2-bromo-3-phenyl- (9CI) |
| 2- | propenal, 2-bromo-3-phenyl-, (2Z)- |
| 2- | propenal, 2-bromo-3-phenyl-, (Z)- |