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Substance Name: Cinnamaldehyde [NF]
RN: 104-55-2
InChIKey: KJPRLNWUNMBNBZ-QPJJXVBHSA-N
Note
- A flavoring agent; an antimutagen but recent studies showed that high doses of cinnamaldehyde in the liver may produce a clastogenic and possibly a promoting effect for hepatocarcinogenesis.
Molecular Formula
- C9-H8-O
Molecular Weight
- 132.1612
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- Classifications
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- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
Classification Codes
- Antimutagenic Agents
- Antineoplastic Agents
- Antineoplastic Agents, Phytogenic
- Flavoring Agents
- Food Additives
- Mutation Data
- Protective Agents
- Repellent
- Reproductive Effect
- Skin / Eye Irritant
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Names and Synonyms
Name of Substance
- 2-Propenal, 3-phenyl-
- 3-Phenyl-2-propenal
- Cinnamal
- Cinnamaldehyde
- Cinnamaldehyde [NF]
- Cinnamic aldehyde
Synonyms
- 2-07-00-00273 (Beilstein Handbook Reference)
- 2-Propenal, 3-phenyl-
- 3-Fenylpropenal
- 3-Fenylpropenal [Czech]
- 3-Phenyl-2-propen-1-al
- 3-Phenyl-2-propenal
- 3-Phenyl-2-propenaldehyde
- 3-Phenylacrolein
- 3-Phenylacrylaldehyde
- 3-Phenylpropenal
- Abion CA
- Acrolein, 3-phenyl-
- AI3-00473
- Aldehyd skoricovy
- Aldehyd skoricovy [Czech]
- Benzylideneacetaldehyde
- beta-Phenylcrolein
- BRN 0605737
- Cassia aldehyde
- Caswell No. 221A
- CCRIS 6222
- Cinnamal
- Cinnamaldehyde
- Cinnamic aldehyde
- Cinnamic aldehyde (natural)
- Cinnamyl aldehyde
- Cinnamylaldehyde
- Cinnemaldehyde
- EC 203-213-9
- EINECS 203-213-9
- EPA Pesticide Chemical Code 040506
- FEMA No. 2286
- FEMA Number 2286
- Hefty Dog and Cat Repellent
- HSDB 209
- NCI-C56111
- NSC 16935
- Phenylacrolein
- Zimtaldehyde
Systematic Names
- 2-Propenal, 3-phenyl-
- Cinnamaldehyde
Superlist Name
- Cinnamaldehyde
Registry Numbers
CAS Registry Number
- 104-55-2
System Generated Number
- 0000104552
Structure Descriptors
InChI
1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+InChIKey
KJPRLNWUNMBNBZ-QPJJXVBHSA-NSmiles
c1(ccccc1)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LD50 | oral | 1160mg/kg (1160mg/kg) | BEHAVIORAL: COMA | Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. |
| mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | FAO Nutrition Meetings Report Series. Vol. 44A, Pg. 16, 1967. | |
| mouse | LD50 | intravenous | 75mg/kg (75mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07571, | |
| mouse | LD50 | oral | 2225mg/kg (2225mg/kg) | BEHAVIORAL: ATAXIA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Yakugaku Zasshi. Journal of Pharmacy. Vol. 92, Pg. 135, 1972. |
| mouse | LDLo | parenteral | 200mg/kg (200mg/kg) | "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 7, Pg. 687, 1955. | |
| rat | LD50 | oral | 2220mg/kg (2220mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" | Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | -7.50E+00 | deg C | EXP | |
| Boiling Point | 246 | deg C | EXP | |
| log P (octanol-water) | 1.9 | (none) | EXP | |
| Water Solubility | 1420 | mg/L | 25 | EXP |
| Henry's Law Constant | 1.60E-06 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 3.79E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.