CAS 460748-15-6 2-(5-Bromo-1-benzofuran-2-yl)ethan-1-ol (HCID 22274657)

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Basic information

CAS: 460748-15-6
Standard SMILES: OCCc1cc2cc(Br)ccc2o1
InChIKey: CBURFCSPYDRJQA-UHFFFAOYSA-N
Molecular formula: C10H9BrO2
Average molar mass: 241.08 g/mol
Monoisotopic mass: 239.97859

Names & identifiers

Preferred name: 2-(5-Bromo-1-benzofuran-2-yl)ethan-1-ol
IUPAC: 2-(5-bromo-1-benzofuran-2-yl)ethanol
English name: 2-(5-Bromo-1-benzofuran-2-yl)ethan-1-ol
Molecular formula: C10H9BrO2
Molecular weight: 241.08

Names & synonyms

2-(5-bromo-1-benzofuran-2-yl)ethan-1-ol460748-15-6RefChem:458635999-243-12-(5-Bromo-1-benzofuran-2-yl)ethanol2-Benzofuranethanol, 5-bromo-SCHEMBL2788486CBURFCSPYDRJQA-UHFFFAOYSA-N2-(5-bromobenzofuran-2-yl)ethanolKTA74815AKOS015962592DB-340752

Show more names

CS-0248202EN300-39364G57982Z382719204

Database identifiers

CAS: 460748-15-6
PubChem CID: 22274657
EC Number: 999-243-1

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 33.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 174

Physicochemical properties

Boiling point: 336.6 · 336.6±27.0 °C(Predicted)
Density: 1.577 · 1.577±0.06 g/cm3(Predicted)
pka: 14.66 · 14.66±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338

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 (100%): 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)

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