α-Bromocinnamaldehyde
Names
[ CAS No. ]:
5443-49-2
[ Name ]:
α-Bromocinnamaldehyde
[Synonym ]:
A-BROMOCINNAMIC ACID
b36
b37
2-bromo-3-phenylpropenal
α-Bromocinnamic aldehyde
(2Z)-2-bromo-3-phenylprop-2-enal
2-Propenal, 2-bromo-3-phenyl-, (Z)-
EINECS 226-637-6
Cinnamaldehyde, α-bromo-
BROMOCINNAMAL
2-Propenal, 2-bromo-3-phenyl-, (2Z)-
Alphabrocine
a-Bromocinnamaldehyde
2-bromo-3-phenylacrylaldehyde
MFCD00006965
2-bromo-3-phenylacrolein
(2Z)-2-Bromo-3-phenylacrylaldehyde
α-Bromocinnamaldehyde
Chemical & Physical Properties
[ Density]:
1.5±0.1 g/cm3
[ Boiling Point ]:
304.4±30.0 °C at 760 mmHg
[ Melting Point ]:
66-68 °C(lit.)
[ Molecular Formula ]:
C9H7BrO
[ Molecular Weight ]:
211.055
[ Flash Point ]:
110.2±11.9 °C
[ Exact Mass ]:
209.968018
[ PSA ]:
17.07000
[ LogP ]:
2.44
[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C
[ Index of Refraction ]:
1.627
[ Storage condition ]:
2-8°C
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- GD6480000
- CHEMICAL NAME :
- Cinnamaldehyde, alpha-bromo-
- CAS REGISTRY NUMBER :
- 5443-49-2
- BEILSTEIN REFERENCE NO. :
- 1099733
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H7-Br-O
- MOLECULAR WEIGHT :
- 211.07
- WISWESSER LINE NOTATION :
- VHYEU1R
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 470 mg/kg
- TOXIC EFFECTS :
- Sense Organs and Special Senses (Eye) - ptosis Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea
MUTATION DATA
- TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 5 nmol/plate
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 110,1,1983
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H302-H315-H319-H335
[ Precautionary Statements ]:
P261-P305 + P351 + P338
[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves
[ Hazard Codes ]:
Xn:Harmful
[ Risk Phrases ]:
R22;R36/37/38
[ Safety Phrases ]:
S26-S36/37/39-S22
[ RIDADR ]:
UN 3335
[ WGK Germany ]:
3
[ RTECS ]:
GD6480000
[ HS Code ]:
2913000090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2913000090
[ Summary ]:
HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%
Articles
Org. Biomol. Chem. 11(36) , 6113-8, (2013)
The Masuda borylation-Suzuki coupling (MBSC) sequence was successfully extended to the challenging coupling of vinylhalides with various (hetero)arylhalides using sterically hindered phosphane ligands...
[Alpha-bromocinnamaldehyde, its mutagenicity and contents in commercial products].Eisei Shikenjo Hokoku. (107) , 21-5, (1989)
The amount of alpha-bromocinnamaldehyde (BCA), an anti-mildew agent, in some commercial products, was examined by high performance liquid chromatography (HPLC) using the following conditions: column, ...
Guanidinium ylide mediated aziridination: identification of a spiro imidazolidine-oxazolidine intermediate.J. Org. Chem. 71(17) , 6600-3, (2006)
We successfully isolated a spiro imidazolidine-oxazolidine intermediate in the reaction of guanidinium ylide mediated aziridination using alpha-bromocinnamaldehyde. X-ray crystallographic analysis una...