Nonaethylene glycol p-nonylphenyl ether
Properties
- Molecular formula
- C33H60O10
- Molar mass
- 616.83 g/mol
- Exact mass
- 616.4186 Da
- Melting point
- 6 °C
- Boiling point
- 250 °C
- Flash point
- 197 °C (closed cup)
- Water solubility
- soluble
- logP
- 4.48Crippen estimate
- Polar surface area
- 103.3 Ų
- H-bond donors / acceptors
- 1 / 10
- Rotatable bonds
- 35
Hazards
Danger
- H302 Harmful if swallowed80.3% of notifiers
- H315 Causes skin irritation75.4% of notifiers
- H318 Causes serious eye damage80.3% of notifiers
- H319 Causes serious eye irritation19.7% of notifiers
- H411 Toxic to aquatic life with long lasting effects48.8% of notifiers
- H412 Harmful to aquatic life with long lasting effects31.5% of notifiers
Aggregated from 203 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P391, P501
Identifiers
CAS number
14409-72-4SMILES
CCCCCCCCCc1ccc(OCCOCCOCCOCCOCCOCCOCCOCCOCCO)cc1InChIKey
FBWNMEQMRUMQSO-UHFFFAOYSA-NInChI
InChI=1S/C33H60O10/c1-2-3-4-5-6-7-8-9-32-10-12-33(13-11-32)43-31-30-42-29-28-41-27-26-40-25-24-39-23-22-38-21-20-37-19-18-36-17-16-35-15-14-34/h10-13,34H,2-9,14-31H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 3,6,9,12,15,18,21,24-Octaoxahexacosan-1-ol, 26-(4-nonylphenoxy)-
- 3,6,9,12,15,18,21,24-Octaoxahexacosan-1-ol, 26-(p-nonylphenoxy)-
- 26-(4-Nonylphenoxy)-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol
- Nonaethylene glycol mono(p-nonylphenyl) ether
- P-Nonylphenol nonaethoxylate
- 2-[2-[2-[2-[2-[2-[2-[2-[2-(4-Nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
- Nonaethylene glycol nonylphenyl ether
Work with Nonaethylene glycol p-nonylphenyl ether
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Polyethylene glycol nonylphenyl ether9016-45-9100 % similar
Np-4026027-38-383 % similar
Diethylene glycol monohexyl ether112-59-456 % similar
3,6,9,12-Tetraoxaeicosan-1-ol19327-39-056 % similar
2-(2-(2-(Dodecyloxy)ethoxy)ethoxy)ethanol3055-94-556 % similar
3,6,9,12,15,18-Hexaoxatriacontan-1-ol3055-96-756 % similar
Heptaethylene glycol dodecyl ether3055-97-856 % similar
Octaethylene glycol monododecyl ether3055-98-956 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.