2H-Pyran, 2-[(8-bromooctyl)oxy]tetrahydro-

HCID 170916

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Basic information

CAS: 50816-20-1
Standard SMILES: BrCCCCCCCCOC1CCCCO1
InChIKey: JCRBYQZIJFWGOO-UHFFFAOYSA-N
Molecular formula: C13H25BrO2
Average molar mass: 293.24 g/mol
Monoisotopic mass: 292.10379214

Names & identifiers

Preferred name: 2H-Pyran, 2-[(8-bromooctyl)oxy]tetrahydro-
IUPAC: 2-(8-bromooctoxy)oxane
English name: 1-BROMO-8-(TETRAHYDROPYRANYLOXY)OCTANE
Molecular formula: C13H25BrO2
Molecular weight: 293.24

Names & synonyms

2H-Pyran, 2-[(8-bromooctyl)oxy]tetrahydro-2-((8-Bromooctyl)oxy)tetrahydro-2H-pyran2-[(8-Bromooctyl)oxy]tetrahydro-2H-pyran8-Bromooctyl tetrahydropyranyl ether1-Bromo-8-tetrahydropyranyloxyoctaneEINECS 256-786-22H-Pyran, 2-((8-bromooctyl)oxy)tetrahydro-DTXSID50885743RefChem:90127DTXCID401025106256-786-2JCRBYQZIJFWGOO-UHFFFAOYSA-N

Show more names

2-(8-bromooctoxy)tetrahydropyran8-Bromooctanol tetrahydropyranyl ether2-[(8-bromooctyl)oxy]tetrahydro-2h-pyra1-bromo-8-(tetrahydropyranoxy)octylalkane

50816-20-11-BROMO-8-(TETRAHYDROPYRANYLOXY)OCTANE2-(8-bromooctoxy)oxane2-[(8-bromooctyl)oxy]oxane2-(8-BROMOOCTYLOXY)TETRAHYDROPYRANMFCD000146481-Bromo-8-(tetrahydro-2-pyranyloxy)octaneSCHEMBL203262

Database identifiers

CAS: 50816-20-1
PubChem CID: 170916
DTXSID: DTXSID50885743
EC Number: 256-786-2
Nikkaji: J236.342I

Properties

Computed structural properties

XLogP: 4.2
Topological polar surface area: 18.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 9
Heavy atoms: 16
Formal charge: 0
Complexity: 153

Physicochemical properties

Boiling point: 130 · 130-132°C 0,8mm
Density: 1.16 · 1.16±0.1 g/cm3(Predicted)
refractive index: 1.477 · 1.4770
Flash point: 110 °C · >110°C
storage temp.: 20 °C · −20°C
BRN: 1306644 · 1306644
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
EPA Substance Registry System: 2 H-Pyran, · 2H-Pyran, 2-[(8-bromooctyl)oxy]tetrahydro- (50816-20-1)
Safety Statements: 24 · 24/25
TSCA: TSCA listed

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.