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2-Ethyl-4-methylpentyl 2-(2,4,5-trichlorophenoxy)propanoate

HCID 40752
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
53404-10-7
Standard SMILES
CCC(COC(=O)C(C)Oc1cc(Cl)c(Cl)cc1Cl)CC(C)C
InChIKey
FHZWKJQPDFHFTI-UHFFFAOYSA-N
Molecular formula
C17H23Cl3O3
Average molar mass
381.7 g/mol
Monoisotopic mass
380.071278

Names & identifiers

Preferred name
2-Ethyl-4-methylpentyl 2-(2,4,5-trichlorophenoxy)propanoate
IUPAC
(2-ethyl-4-methylpentyl) 2-(2,4,5-trichlorophenoxy)propanoate
English name
2-ethyl-4-methylpentyl 2-(2,4,5-trichlorophenoxy)propionate
Molecular formula
C17H23Cl3O3
Molecular weight
381.72

Names & synonyms

53404-10-72-ETHYL-4-METHYLPENTYL 2-(2,4,5-TRICHLOROPHENOXY)PROPANOATESilvex 2-ethyl-4-methylpentyl ester8G3XLL32VU2-Ethyl-4-methylpentyl 2-(2,4,5-trichlorophenoxy)propionatePropanoic acid, 2-(2,4,5-trichlorophenoxy)-, 2-ethyl-4-methylpentyl esterEINECS 258-522-1UNII-8G3XLL32VUDTXSID8058401SCHEMBL31349870FHZWKJQPDFHFTI-UHFFFAOYSA-NDB-260990
Show more names
2-(2,4,5-Trichlorophenoxy)propanoic acid 2-ethyl-4-methylpentyl ester
NS00032747Silvex, isooctyl (2-ethyl-4-methylpentyl) esterQ27270372

Database identifiers

CAS
53404-10-7
PubChem CID
40752
DTXSID
DTXSID8058401
UNII
8G3XLL32VU
EC Number
258-522-1
Nikkaji

Properties

Computed structural properties

XLogP
7
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
23
Formal charge
0
Complexity
365

Physicochemical properties

FDA UNII
8 G3XLL32VU · 8G3XLL32VU
EPA Substance Registry System
2 · Silvex 2-ethyl-4-methylpentyl ester (53404-10-7)

Chemistry & industry

Suppliers1 total

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
J295.945C