Basic information
- CAS
916420-50-3- Standard SMILES
COc1c(F)cccc1CBr- InChIKey
OYXRYBDZSXMMPU-UHFFFAOYSA-N- Molecular formula
- C8H8BrFO
- Average molar mass
- 219.05 g/mol
- Monoisotopic mass
- 217.97426
Names & identifiers
- Preferred name
- 3-Fluoro-2-methoxybenzyl bromide
- IUPAC
- 1-(bromomethyl)-3-fluoro-2-methoxybenzene
- English name
- 3-FLUORO-2-METHOXYBENZYL BROMIDE
- Molecular formula
- C8H8BrFO
- Molecular weight
- 219.05
Names & synonyms
3-FLUORO-2-METHOXYBENZYL BROMIDE916420-50-31-(bromomethyl)-3-fluoro-2-methoxybenzeneMFCD09025370SCHEMBL19814847SCHEMBL29912077RLB42050SBB095698AKOS0159567843-FLUORO-2-METHOXYBENZYLBROMIDEAS-36742DB-161661
Show more names
Benzene, 1-(bromomethyl)-3-fluoro-2-methoxy-
1-(bromomethyl)-3-fluoro-2-methoxy-benzeneEN300-1895119F342741
Database identifiers
- CAS
916420-50-3- PubChem CID
- 46737536
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 121
Physicochemical properties
- Boiling point
- 232 · 232.0±25.0 °C(Predicted)
- Density
- 1.488 · 1.488±0.06 g/cm3(Predicted)
- form
- liquid
- color
- Clear, light yellow
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 310 · P310-P260-P280
- HS Code
- 2909309090 · 2909309090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2909309090
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P310-P260-P280
Chemistry & industry
Suppliers6 total
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
北京依特能化学科技有限责任公司010-59484199 18611897322;18611897322 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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