4-Bromo-2-(hydroxymethyl)-6-methoxyphenol

HCID 894092

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Basic information

CAS: 35090-64-3
Standard SMILES: COc1cc(Br)cc(CO)c1O
InChIKey: UBLQIISPEAEAIX-UHFFFAOYSA-N
Molecular formula: C8H9BrO3
Average molar mass: 233.06 g/mol
Monoisotopic mass: 231.97350625

Names & identifiers

Preferred name: 4-Bromo-2-(hydroxymethyl)-6-methoxyphenol
IUPAC: 4-bromo-2-(hydroxymethyl)-6-methoxyphenol
English name: 4-Bromo-2-(hydroxymethyl)-6-methoxybenzenol
Molecular formula: C8H9BrO3
Molecular weight: 233.06

Names & synonyms

4-bromo-2-(hydroxymethyl)-6-methoxyphenol35090-64-3DTXSID60358418RefChem:519537DTXCID50309474818-742-64-Bromo-2-(Hydroxymethyl)-6-MethoxybenzenolMFCD020819864-bromo-2-hydroxymethyl-6-methoxyphenolBionet2_000506SCHEMBL293625UBLQIISPEAEAIX-UHFFFAOYSA-N

Show more names

RARECHEM AL BD 02455-BROMO-2-HYDROXY-3-METHOXYBENZYL ALCOHOLBenzenemethanol, 5-bromo-2-hydroxy-3-methoxy-

HMS1365G22KBA09064SBB079143AKOS0003389704-Bromo-2-hydroxymethyl-6-methoxy-phenolDB-1136374-bromo-2-(hydroxymethyl)-6-methoxy-phenolCS-0118797

Database identifiers

CAS: 35090-64-3
PubChem CID: 894092
DTXSID: DTXSID60358418
EC Number: 818-742-6

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 49.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 12
Formal charge: 0
Complexity: 142

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HS Code: 2909500090 · 2909500090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): 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)

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