8-Bromooct-1-ene (HCID 75907)

Names & identifiers

Preferred name: 8-Bromooct-1-ene
IUPAC: 8-bromooct-1-ene
English name: 8-Bromo-1-octene
Molecular formula: C8H15Br
Molecular weight: 191.11

Names & synonyms

8-Bromo-1-octene2695-48-98-Bromooct-1-eneEINECS 220-268-4SNMOMUYLFLGQQS-UHFFFAOYSA-DTXSID30181437RefChem:547856DTXCID40103928220-268-4InChI=1/C8H15Br/c1-2-3-4-5-6-7-8-9/h2H,1,3-8H21-Octene, 8-bromo-MFCD00000275

Show more names

DK712bromo-8 octene-18-Bromo-1-octene 97%8-Bromooct-1-ene 98%8- Bromine-1- octene8-Bromo-1-octene >

7-Octenyl Bromide8-bromoocteneE79E33RNF78-bromo-oct-1-eneCH2=CH(CH2)6BrUNII-E79E33RNF78-Bromo-1-octene, 97%SCHEMBL346392

Database identifiers

CAS: 2695-48-9
PubChem CID: 75907
DTXSID: DTXSID30181437
UNII: E79E33RNF7
EC Number: 220-268-4
Nikkaji: J192.202E

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 6
Heavy atoms: 9
Formal charge: 0
Complexity: 59

Experimental & physicochemical properties

Kovats Retention Index · 2 items

1121

1455

Physicochemical properties

Boiling point: 198 · 198-199°
Density: 1.139 g/mL · 1.139 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.467(lit.)
Flash point: 78 °C · 78°C
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
solubility: Chloroform, Ethyl Acetate
form: Liquid
color: Pale yelllow
BRN: 2234481 · 2234481
InChI: 1S/C8H15Br/c1-2-3-4-5-6-7-8-9/h2H,1,3-8H2
InChIKey: SNMOMUYLFLGQQS-UHFFFAOYSA-N
SMILES: BrCCCCCCC=C
FDA UNII: 79 E33RNF7 · E79E33RNF7
NIST Chemistry Reference: 8 · 8-Bromo-1-octene(2695-48-9)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
HazardClass: IRRITANT
HS Code: 29033990 · 29033990
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.7%)

Safety data

PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
hs_code: 29033990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
hazard_class: IRRITANT
Storage Class: 10 - Combustible liquids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 1 item

Uses8-Bromo-1-octene has been used in preparation of polymerizable ligand, required for the synthesis of quantum dot-labeled polymer beads. Grignard reagent derived from 8-bromo-1-octene has been used in the synthesis of (2S,3S,5R)-5-[(1R)-1-hydroxy-9-decenyl]-2-pentyltetrahydro-3-furanol. It has been used as building block in natural product synthesis. Also used for the synthesis of more complex pharmaceutical compounds, such as Dithienogermole (DTG) derivatives with varying alkyl chain lengths and pendant functionalities.