1-Bromo-2-[(2-methylphenoxy)methyl]benzene

HCID 223552

Notes Reactions

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Basic information

CAS: 5422-50-4
Standard SMILES: Cc1ccccc1OCc1ccccc1Br
InChIKey: OKVTYLOXWGCLBB-UHFFFAOYSA-N
Molecular formula: C14H13BrO
Average molar mass: 277.16 g/mol
Monoisotopic mass: 276.01498

Names & identifiers

Preferred name: 1-Bromo-2-[(2-methylphenoxy)methyl]benzene
IUPAC: 1-bromo-2-[(2-methylphenoxy)methyl]benzene

Names & synonyms

5422-50-41-Bromo-2-((o-tolyloxy)methyl)benzene2-Bromobenzyl-(2-methylphenyl)ether1-bromo-2-[(2-methylphenoxy)methyl]benzeneMFCD07782569NSC112871-[(2-BROMOPHENYL)METHOXY]-2-METHYLBENZENESCHEMBL2292785SCHEMBL30342568DTXSID90279107OKVTYLOXWGCLBB-UHFFFAOYSA-NNSC-11287

Show more names

AKOS0089514722-[(2-methylphenoxy)-methyl]-1-bromo-benzeneF395732

Database identifiers

CAS: 5422-50-4
PubChem CID: 223552
DTXSID: DTXSID90279107
Nikkaji: J2.078.483K

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 207

Related reactions

2 records

New reaction record

HRID 186433As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 567120As reactantuspto-grants-2001_01

Compound notes

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