Basic information
- Standard SMILES
CC(=O)[O-].c1cc[c]([Sn+]([c]2ccccc2)[c]2ccccc2)cc1- InChIKey
WDQNIWFZKXZFAY-UHFFFAOYSA-M- Molecular formula
- C20H18O2Sn
- Average molar mass
- 409.1 g/mol
- Monoisotopic mass
- 410.032882
Names & identifiers
- Preferred name
- Triphenyltin hydroxide acetate
- IUPAC
- triphenylstannanylium acetate
- English name
- Triphenyltin acetate
- Molecular formula
- C20H18O2Sn
- Molecular weight
- 409.07
Names & synonyms
Show more names
Database identifiers
- CAS
900-95-8- PubChem CID
- 9909408
- UNII
- 70M92GQA9T
Properties
Computed structural properties
- Topological polar surface area
- 40.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 227
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 118 · 118-122°C
- Boiling point
- 60 °C · 60 °C
- Density
- 1.55 · 1.55
- vapor pressure
- 1.9 x · 1.9 x 10-3 Pa (60 °C)
- storage temp.
- 4 °C · APPROX 4°C
- solubility
- Chloroform (Slightly)
- form
- Powder
- color
- white
- Water Solubility
- 28 mg/L · 28 mg/L (20 ºC)
- Hydrolytic Sensitivity
- 7 · 7: reacts slowly with moisture/water
- Merck
- 14 · 14,9745
- Henry's Law Constant
- 2 · 2.0×103 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- CAS DataBase Reference
- 900 · 900-95-8(CAS DataBase Reference)
- EWG's Food Scores
- 4 · 4-6
- FDA UNII
- 70 M92GQA9T · 70M92GQA9T
- NIST Chemistry Reference
- Triphenyl tin acetate(900-95-8)
- EPA Substance Registry System
- Fentin acetate (900-95-8)
- Symbol(GHS)
- 5 · GHS05,GHS06,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H315-H318-H330-H335-H351-H372-H410
- Precautionary statements
- 264 · P264-P270-P280-P260-P271-P284-P261-P201-P202-P273-P301+P310-P330-P302+P352-P312-P361+P364-P332+P313-P362+P364-P305+P351+P338-P310-P304+P340-P308+P313-P314-P391-P405-P403+P233-P501
- Hazard Codes
- T+;N,N,T+
- Risk Statements
- 24 · 24/25-26-37/38-40-41-48/23-50/53-63
- Safety Statements
- 26 · 26-28-36/37/39-45-60-61
- RIDADR
- 3146 · 3146
- RTECS
- 6650000 · WH6650000
- TSCA
- TSCA listed
- HazardClass
- 6.1 · 6.1
- PackingGroup
- III
- Hazardous Substances Data
- 900 · 900-95-8(Hazardous Substances Data)
- Toxicity
- 50 oral · LD50 oral in rabbit: 30mg/kg
Safety & regulation
Safety data
- tsca
- TSCA listed
- rtecs
- WH6650000
- ridadr
- 3146
- Toxicity
- LD50 oral in rabbit: 30mg/kg
- risk_code
- 24/25-26-37/38-40-41-48/23-50/53-63
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06,GHS08,GHS09
- hazard_code
- T+;N,N,T+
- safety_code
- 26-28-36/37/39-45-60-61
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H301-H311-H315-H318-H330-H335-H351-H372-H410
- Precautionary statements
- P264-P270-P280-P260-P271-P284-P261-P201-P202-P273-P301+P310-P330-P302+P352-P312-P361+P364-P332+P313-P362+P364-P305+P351+P338-P310-P304+P340-P308+P313-P314-P391-P405-P403+P233-P501
- Hazardous Substances Data
- 900-95-8(Hazardous Substances Data)
Chemistry & industry
Pharmacology
Applications
DescriptionFentin acetate is an obsolete organotin fungicide. It has a low aqueous solubility and low volatility. Evidence suggests it is quite persistent in soil systems but less so in aquatic systems. Based on its physico-chemical properties it is not expected to leach to groundwater. Ecotoxicological data is limited but acute oral ecotoxicity tends to be high. It is moderately toxic to mammals via the oral route.
UsesTriphenyltin Acetate is an organotin compound. Triphenyltin Acetate much like its hydroxide analogue is used as a fungicide and antifeeding compound for insect control. Recent studies show that Triphenyltin Acetate may have adverse effects on the reproductive and immune systems and may disrupt the endocrine system.
UsesFentin is a non-systemic fungicide with protective and curative action. It is used to control early and late blight in potatoes and a range of diseases in vegetables, sugar beet, peanuts, wheat, coffee, cocoa and pecans. It is also used to control algae and snails in rice fields. Fentin has previously been used as an antifoulant in marine paint.
General DescriptionA white crystalline solid. Melting point 123-131°C (253-268°F). Used as a fungicide, algaecide and molluscicide. Controls early and late blight on potatoes.
Upstream & downstream products
Upstream raw materials
Suppliers50 total
Additional notes
DefinitionChEBI: An organotin compound that is the O-acetyl derivative of triphenyltin hydroxide. A fungicide used to control blights on potatoes, leaf spot diseases on sugar beet and anthracnose on beans.
Related reactions
Linked notes
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