1-Bromo-2-ethylbenzene

HCID 16089
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Basic information

CAS
1973-22-4
Standard SMILES
CCc1ccccc1Br
InChIKey
HVRUGFJYCAFAAN-UHFFFAOYSA-N
Molecular formula
C8H9Br
Average molar mass
185.06 g/mol
Monoisotopic mass
183.98876239

Names & identifiers

Preferred name
1-Bromo-2-ethylbenzene
IUPAC
1-bromo-2-ethylbenzene
English name
2-Bromoethylbenzene
Molecular formula
C8H9Br
Molecular weight
185.06

Names & synonyms

1-BROMO-2-ETHYLBENZENE1973-22-4o-BromoethylbenzeneBenzene, 1-bromo-2-ethyl-2-Ethylbromobenzene1-Bromo-2-EthYl-Benzene2-bromophenyl ethaneMFCD000000771-Bromo-2-ethyl benzene1-Bromo-2-ethylbenzene, 99%DTXSID20173402CS-W016966
Show more names
C8H9Br1-Bromo-2-ethyLBromoathylbenzene2-Brom-ethylbenzol2-Bromoethylbenzeneo-ethylbromobenzene1-Ethyl-2-brombenzol
Z12554573721-Ethyl-2-bromobenzene2-Bromo-1-ethylbenzeneEINECS 217-823-8Bromo-2-ethylbenzeneTBE7SE8H6Qbenzene, 1-bromo-2-ethylSCHEMBL155397

Database identifiers

CAS
1973-22-4
PubChem CID
16089
DTXSID
DTXSID20173402
UNII
TBE7SE8H6Q
EC Number
217-823-8
Nikkaji
J99.474J

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
9

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Halogenated Monoaromatics
SpringerMaterials PropertiesBoiling point
Physical DescriptionClear colorless liquid; [Sigma-Aldrich MSDS]

Physicochemical properties

Melting point
-56 °C · -56 °C
Boiling point
199 °C · 199 °C(lit.)
Density
1.338 g/mL · 1.338 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.549(lit.)
Flash point
171 °F · 171 °F
storage temp.
Sealed in dry,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (93.8%): 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 48 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Chemical: Benzene, 1-bromo-2-ethyl-

Benzene, 1-bromo-2-ethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS] See Ethyl benzene.
Hazard Classes and CategoriesSkin Irrit. 2 (93.8%)

Safety data

F
9
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 3082 9/PG 3
hs_code
29036990
risk_code
36/37/38-51/53

Chemistry & industry

Applications · 2 items

Uses1-Bromo-2-ethylbenzene may be used in the synthesis of:1-(2′-ethylphenyl)ethanolN-benzyl-P-(2-ethylphenyl)-P-phenylphosphinic amide4-(isopropyldimethylsilyl)-2-(2-ethylphenyl)pyridine5-amino-2′-ethyl -biphenyl-2-ol, used for modification of carbon paste electrode

General Description1-Bromo-2-ethylbenzene is an organobromine compound.

Upstream & downstream products

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
山东玖玥生物科技有限公司18853316981

Related reactions

19 records
New reaction record

Compound notes

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