Basic information
- CAS
2253887-19-1- Standard SMILES
Brc1ccc(I)cc1OCc1ccccc1- InChIKey
QVTXKRNPVVCAJD-UHFFFAOYSA-N- Molecular formula
- C13H10BrIO
- Average molar mass
- 389.03 g/mol
- Monoisotopic mass
- 387.89598
Names & identifiers
- Preferred name
- 2-(Benzyloxy)-1-bromo-4-iodobenzene
- IUPAC
- 1-bromo-4-iodo-2-phenylmethoxybenzene
Names & synonyms
2-(Benzyloxy)-1-bromo-4-iodobenzene2253887-19-1RefChem:459752889-572-8MFCD334039041-bromo-4-iodo-2-phenylmethoxybenzeneSCHEMBL205763952-benzyloxy-1-bromo-4-iodo-benzene2-(Benzyloxy)-1-bromo-4-iodobenzene, 95%CS-0190774E96672F628753
Show more names
A1-84448
Database identifiers
- CAS
2253887-19-1- PubChem CID
- 11516618
- EC Number
- 889-572-8
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 206
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
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.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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