| Identification | More | [Name]
3-Bromocinnamic acid | [CAS]
32862-97-8 | [Synonyms]
(2E)-3-(3-BROMOPHENYL)ACRYLIC ACID
3-BROMOCINNAMIC ACID
AKOS B004044
AKOS BBS-00006566
BROMOCINNAMIC ACID,3-
M-BROMOCINNAMIC ACID
M-BROMOPHENYLACRYLIC ACID
RARECHEM BK HC T307
TRANS-3-BROMOCINNAMIC ACID
(2E)-3-(3-Bromophenyl)-2-propenoic acid
2-Propenoic acid, 3-(3-bromophenyl)-
3-(3-bromophenyl)-2-propenoicaci
3-(3-bromophenyl)-2-propenoicacid
BW A800U
Cinnamic acid, m-bromo-
m-bromo-cinnamicaci
3-Bromocinnamic acid,predominantly trans
3-BROMOCINNAMIC ACID, 98%, PREDOMINANTLY TRANS
3-Bromocinnamic acid, 98+%
3-Bromocinnamic acid 97% | [EINECS(EC#)]
251-267-7 | [Molecular Formula]
C9H7BrO2 | [MDL Number]
MFCD00004382 | [Molecular Weight]
227.05 | [MOL File]
32862-97-8.mol |
| Chemical Properties | Back Directory | [Appearance]
white to light yellow crystal powder | [Melting point ]
177-179 °C(lit.)
| [Boiling point ]
344.1±25.0 °C(Predicted) | [density ]
1.5403 (rough estimate) | [refractive index ]
1.5627 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
methanol: soluble | [form ]
Crystalline Powder | [pka]
4.27±0.10(Predicted) | [color ]
White to light yellow | [InChI]
InChI=1S/C9H7BrO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12) | [InChIKey]
YEMUSDCFQUBPAL-SNAWJCMRSA-N | [SMILES]
C(O)(=O)C=CC1=CC=CC(Br)=C1 | [CAS DataBase Reference]
32862-97-8(CAS DataBase Reference) | [NIST Chemistry Reference]
3-Bromocinnamic acid(32862-97-8) | [EPA Substance Registry System]
32862-97-8(EPA Substance) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H315-H319-H335 | [Precautionary statements ]
P261-P264-P271-P280-P302+P352-P305+P351+P338 | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin .
R37/38:Irritating to respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing . | [WGK Germany ]
3
| [RTECS ]
GD8420000
| [Hazard Note ]
Irritant | [TSCA ]
TSCA listed | [HazardClass ]
IRRITANT | [HS Code ]
29163990 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Description]
3-Bromocinnamic acid (also known as m-Bromocinnamic acid, 3-(3-Bromophenyl)-2-propenoic acid) is the primary active metabolite of the anticonvulsant drug cinromide (3-bromo-N-ethylcinnamamide). In vivo studies suggest that 3-Bromocinnamic acid may possess certain anticonvulsant properties and is primarily used in clinical testing and research related to cinromide. | [Chemical Properties]
white to light yellow crystal powder | [Uses]
3-Bromocinnamic acid is an organic synthesis intermediate. | [Preparation]
synthesis of 3-bromocinnamic acid from an aryl iodide (3 bromoiodobenzene) and acrylic acid. | [General Description]
3-Bromocinnamic acid is the metabolite of cinromide (3-bromo-N-ethylcinnamamide) and can be analysed in plasma by high-performance liquid chromatographic method. |
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