5-Hydroxy-2-iodobenzaldehyde
Basic information
- CAS
50765-11-2- Standard SMILES
O=Cc1cc(O)ccc1I- InChIKey
JRJRYFRHGBHRHI-UHFFFAOYSA-N- Molecular formula
- C7H5IO2
- Average molar mass
- 248.02 g/mol
- Monoisotopic mass
- 247.93343
Names & identifiers
- Preferred name
- 5-Hydroxy-2-iodobenzaldehyde
- IUPAC
- 5-hydroxy-2-iodobenzaldehyde
- English name
- 5-Hydroxy-2-iodobenzaldehyde
- Molecular formula
- C7H5IO2
- Molecular weight
- 248.02
Names & synonyms
5-hydroxy-2-iodobenzaldehyde50765-11-25-Hydroxy-2-iodo-benzaldehydeMFCD09025923NSC1296092-Jod-5-oxy-benzaldehydSCHEMBL4259432DTXSID70299363AKOS015904200NSC-129609DS-16223SY104099
Show more names
2-iodo-5-hydroxybenzaldehydeBenzaldehyde, 5-hydroxy-2-iodo-
FT-0718701SCHEMBL30134370SBB1003465-hydroxy-2-iodobenzaldehyde, AldrichCPRDB-071250F222757
Database identifiers
- CAS
50765-11-2- PubChem CID
- 279261
- DTXSID
DTXSID70299363
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- Melting point
- 125 °C · 125 °C
- Boiling point
- 322.2 · 322.2±32.0 °C(Predicted)
- Density
- 2.039 · 2.039±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 8.63 · 8.63±0.18(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 280 · P280-P301+P312-P362+P364
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-41
- Safety Statements
- 26 · 26-39
- HS Code
- 2913000090 · 2913000090
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
- 2913000090
- risk_code
- 22-41
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-39
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P280-P301+P312-P362+P364
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…