2-(4-(Triphenylphosphoranyl)butoxy)benzaldehyde
Basic information
- CAS
52032-55-0- Standard SMILES
O=Cc1ccccc1OCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
BPSLEMMGPHEIBA-UHFFFAOYSA-N- Molecular formula
- C29H28O2P+
- Average molar mass
- 439.5 g/mol
- Monoisotopic mass
- 439.18269213
Overview
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Names & identifiers
- Preferred name
- 2-(4-(Triphenylphosphoranyl)butoxy)benzaldehyde
- IUPAC
- 4-(2-formylphenoxy)butyl-triphenylphosphanium
- English name
- (4-(2-Formylphenoxy)butyl)triphenylphosphonium bromide
- Molecular formula
- C29H28BrO2P
- Molecular weight
- 519.42
Names & synonyms
2-(4-(Triphenylphosphoranyl)butoxy)benzaldehyde52032-55-0NSC 110608NSC110608NSC-1106085Y2RVL3VX7DTXSID80200006[4-(2-Formylphenoxy)butyl]triphenylphosphonium4-(2-formylphenoxy)butyl-triphenyl-phosphonium[4-(2-Formylphenoxy)butyl]tri(phenyl)phosphaniumPhosphonium, [4-(2-formylphenoxy)butyl]triphenyl-754126-95-9
Show more names
(4-(2-Formylphenoxy)butyl)triphenylphosphonium bromide
Database identifiers
- CAS
52032-55-0、754126-95-9- PubChem CID
- 494087
- DTXSID
DTXSID80200006- UNII
- 5Y2RVL3VX7
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 1
- Complexity
- 486
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
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Compound notes
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