Basic information
- CAS
93-78-7- Standard SMILES
CC(C)OC(=O)COc1cc(Cl)c(Cl)cc1Cl- InChIKey
SXHQLHGHMREHMX-UHFFFAOYSA-N- Molecular formula
- C11H11Cl3O3
- Average molar mass
- 297.6 g/mol
- Monoisotopic mass
- 295.977377
Names & identifiers
- Preferred name
- 2,4,5-T-isopropyl
- IUPAC
- propan-2-yl 2-(2,4,5-trichlorophenoxy)acetate
- English name
- 2.4.5-T ISOPROPYL ESTER
- Molecular formula
- C11H11Cl3O3
- Molecular weight
- 297.56
Names & synonyms
2,4,5-T isopropyl ester2,4,5-T-isopropylCaswell No. 881T2,4,5-T-isopropyl [ISO]Isopropyl 2,4,5-trichlorophenoxyacetateUNII-EG70MZA02YEINECS 202-275-4EG70MZA02YEPA Pesticide Chemical Code 082066BRN 25380162,4,5-T, ISOPROPYL ESTER1-Methylethyl (2,4,5-trichlorophenoxy)acetate
Show more names
2,4,5-Trichlorophenoxyacetic acid isopropylIsopropyl 2-(2,4,5-trichlorophenoxy)acetate1-methylethyl(2,4,5-trichlorophenoxy)acetatepropan-2-yl 2-(2,4,5-trichlorophenoxy)acetatepropan-2-yl 2-(2,4,5-trichlorophenoxy)ethanoate(2,4,5-trichlorophenoxy)-aceticaciisopropylester2,4,5-T isopropyl ester Solution in Acetonitrile(2,4,5-trichlorophenoxy)-aceticaci1-methylethylester2-(2,4,5-trichlorophenoxy)acetic acid isopropyl ester
2,4,5-Trichlorophenoxyacetic acid, isopropyl esterDTXSID70413324-06-00-00974 (Beilstein Handbook Reference)Isopropyl (2,4,5-trichlorophenoxy)acetateAcetic acid,(2,4,5-trichloropheoxy)-, isopropyl esterAcetic acid, (2,4,5-trichlorophenoxy)-, 1-methyl esterACETIC ACID, 2-(2,4,5-TRICHLOROPHENOXY)-, 1-METHYLETHYL ESTERRefChem:81991
Database identifiers
- CAS
93-78-7- PubChem CID
- 7160
- DTXSID
DTXSID7041332- UNII
- EG70MZA02Y
- EC Number
- 202-275-4
- Nikkaji
- J4.685J
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Physicochemical properties
- Melting point
- 45 °C · 45°C
- Boiling point
- 411.19 °C · 411.19°C (rough estimate)
- Density
- 1.4103 · 1.4103 (rough estimate)
- refractive index
- 1.532 · 1.5320 (estimate)
- CAS DataBase Reference
- 93 · 93-78-7
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 70 MZA02Y · EG70MZA02Y
- EPA Substance Registry System
- 2 · 2,4,5-T isopropyl ester (93-78-7)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- RIDADR
- 3345 · 3345
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Peroxide Forming Chemical
2,4,5-T isopropyl ester
D: Other compounds that may form peroxides
Kelly
Safety data
- ridadr
- 3345
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- 6.1(b)
- packing_group
- III
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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