Basic information
- CAS
19997-48-9- Standard SMILES
Cc1ccc2c(c1)CC(CBr)O2- InChIKey
KUDMJKVKBRFFND-UHFFFAOYSA-N- Molecular formula
- C10H11BrO
- Average molar mass
- 227.1 g/mol
- Monoisotopic mass
- 225.99933
Names & identifiers
- Preferred name
- 2-(Bromomethyl)-2,3-dihydro-5-methylbenzofuran
- IUPAC
- 2-(bromomethyl)-5-methyl-2,3-dihydro-1-benzofuran
- English name
- 2-(bromomethyl)-2,3-dihydro-5-methylbenzofuran
- Molecular formula
- C10H11BrO
- Molecular weight
- 227.1
Names & synonyms
19997-48-92-(Bromomethyl)-2,3-dihydro-5-methylbenzofuranEINECS 243-456-8NSC 118099RefChem:84584243-456-82-(bromomethyl)-5-methyl-2,3-dihydro-1-benzofuranNSC118099SCHEMBL4230337KUDMJKVKBRFFND-UHFFFAOYSA-NDTXSID301247935AKOS017548010
Show more names
Benzofuran, 2-(bromomethyl)-2,3-dihydro-5-methyl-
NSC-118099NS00048708
Database identifiers
- CAS
19997-48-9- PubChem CID
- 89258
- DTXSID
DTXSID301247935- EC Number
- 243-456-8
- Nikkaji
- J280.416F
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Boiling point
- 295.3 · 295.3±9.0 °C(Predicted)
- Density
- 1.418 · 1.418±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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