CAS 2216-90-2 Ethyl bromophenylacetate (HCID 97780)

Names & identifiers

Preferred name: Ethyl bromophenylacetate
IUPAC: ethyl 2-bromo-2-phenylacetate
English name: Ethyl α-bromophenylacetate
Molecular formula: C10H11BrO2
Molecular weight: 243.1

Names & synonyms

ethyl 2-bromo-2-phenylacetateEthyl alpha-bromophenylacetateEthyl bromophenylacetateBenzeneacetic acid, alpha-bromo-, ethyl esterDTXSID8041951Benzeneacetic acid, .alpha.-bromo-, ethyl ester0N3C9JY41XEINECS 220-735-2NSC-38807DTXCID6021951NSC 38807DL-.ALPHA.-BROMOPHENYLACETIC ACID ETHYL ESTER

Show more names

ETHYL 2-(2-BROMOPHENYL)ACETATEETHYL A-BROMOPHENYLACETATEETHYL 2-BROMOPHENYLACETATEethyl à-bromophenylacetateethyleα-bromophenylacetateEthyl bromo(phenyl)acetateEthyl α-bromophenylacetate

RefChem:596144ETHYL BROMOPHENYLACETATE, (+-)-ETHYL (+-)-ALPHA-BROMOPHENYLACETATEETHYL (+-)-ALPHA-BROMOBENZENEACETATEETHYL (+-)-.ALPHA.-BROMOBENZENEACETATEETHYL (+-)-.ALPHA.-BROMOPHENYLACETATEDL-ALPHA-BROMOPHENYLACETIC ACID ETHYL ESTER220-735-2

Database identifiers

CAS: 2216-90-2、2882-19-1
PubChem CID: 97780
DTXSID: DTXSID8041951
ChEMBL: CHEMBL3187649
UNII: 0N3C9JY41X
EC Number: 218-701-7、220-735-2
Nikkaji: J62.890E

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 13
Formal charge: 0
Complexity: 164

Physicochemical properties

Boiling point: 89 · 89-92 °C/0.9 mmHg (lit.)
Density: 1.389 g/mL · 1.389 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D >1.5390(lit.)
Flash point: 230 °F · >230 °F
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
form: Liquid
color: Clear colorless to yellow
Water Solubility: Not miscible or difficult to mix in water.
Sensitive: Moisture Sensitive
InChI: 1S/C10H11BrO2/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3
InChIKey: BKTKLDMYHTUESO-UHFFFAOYSA-N
SMILES: CCOC(=O)C(Br)c1ccccc1
CAS DataBase Reference: 2882 · 2882-19-1(CAS DataBase Reference)
FDA UNII: 0 N3C9JY41X · 0N3C9JY41X
EPA Substance Registry System: Ethyl .alpha.-bromophenylacetate (2882-19-1)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes: C
Risk Statements: 34 · 34
Safety Statements: 26 · 26-36/37/39-45
RIDADR: 3265 · UN 3265 8/PG 2
WGK Germany: 3 · 3
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29163990 · 29163990
Storage Class: 8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications: 1 Skin · Eye Dam. 1Skin Corr. 1B
Limited Quantities: 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: UN 3265 8/PG 2
hs_code: 29163990
risk_code: 34
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
Storage Class: 8A - Combustible corrosive hazardous materials
packing_group: III
Hazard statements: H314
Limited Quantities: 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
Precautionary statements: P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405

Chemistry & industry

Applications

Usesα-Bromobenzeneacetic acid ethyl ester is used as an alkyl halide initiator in controlled/living radical polymerization of styrene and methyl methacrylate.

UsesETHYL ALPHA-BROMOPHENYLACETATE is used as an alkyl halide initiator in controlled/living radical polymerization of styrene and methyl methacrylate.