CAS 15795-20-7 Ethyl 4-bromocinnamate (HCID 141107)

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Basic information

CAS: 15795-20-7
Standard SMILES: CCOC(=O)C=Cc1ccc(Br)cc1
InChIKey: YOOKYIPLSLPRTC-UHFFFAOYSA-N
Molecular formula: C11H11BrO2
Average molar mass: 255.11 g/mol
Monoisotopic mass: 253.99424169

Names & identifiers

Preferred name: Ethyl 4-bromocinnamate
IUPAC: ethyl 3-(4-bromophenyl)prop-2-enoate
English name: Ethyl 3-(4-BroMophenyl)acrylate
Molecular formula: C11H11BrO2
Molecular weight: 255.11

Names & synonyms

15795-20-7ETHYL 4-BROMOCINNAMATERefChem:595357631-524-3Ethyl 3-(4-bromophenyl)acrylateethyl 3-(4-bromophenyl)prop-2-enoate2-Propenoic acid, 3-(4-bromophenyl)-, ethyl esterethyl p-bromocinnamateNSC636702ethyl 4-bromo-cinnamateEthyl 4 -bromocinnamateSCHEMBL69277

Show more names

Ethyl 3-(4-bromophenyl)-2-propenoate

DTXSID80947262YOOKYIPLSLPRTC-UHFFFAOYSA-NXH0881AKOS0172657623-(4-bromophenyl)acrylic acid ethyl esterDB-046430DB-064197F980096

Database identifiers

CAS: 15795-20-7、24393-53-1
PubChem CID: 141107
DTXSID: DTXSID80947262
EC Number: 631-524-3

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 14
Formal charge: 0
Complexity: 205

Physicochemical properties

Boiling point: 180 · 180-181 °C(Press: 10 Torr)
Density: 1.393 · 1.393±0.06 g/cm3(Predicted)
storage temp.: 2 · Storage temp. 2-8°C
Appearance: Colorless to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H319-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H335-H319-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362