Kresoxym-methyl
Basic information
- CAS
248582-68-5- Standard SMILES
CO/N=C(\C(=O)OC)c1ccccc1COc1ccccc1C- InChIKey
ZOTBXTZVPHCKPN-ZPHPHTNESA-N- Molecular formula
- C18H19NO4
- Average molar mass
- 313.3 g/mol
- Monoisotopic mass
- 313.13140809
Overview
Kresoxim-methyl can cause cancer according to The Environmental Protection Agency (EPA).
Names & identifiers
- Preferred name
- Kresoxym-methyl
- IUPAC
- methyl (2Z)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate
Names & synonyms
KRESOXYM-METHYLRefChem:1088065248582-68-5(E)-Methyl 2-(methoxyimino)-2-(2-((o-tolyloxy)methyl)phenyl)acetate(Z)-isomer Kresoxim-methylmethyl E-2-methoxyimino-2-[(2-methylphenoxymethyl)phenyl]acetatemethyl (2Z)-2-methoxyimino-2-[2-[(2-methylphenoxy)methyl]phenyl]acetate(Z)-Kresoxim-methyCHEMBL2268524SCHEMBL12920836DTXSID00861370AKOS015895781
Show more names
AS-6206methyl E-2-methoxyimino-2-[(2-methylphenoxymethyl)-phenyl]acetatemethyl E-2-methoxyimino-2-[(2-methylphenyloxymethyl)-phenyl]acetateMethyl (2Z)-(methoxyimino){2-[(2-methylphenoxy)methyl]phenyl}acetate
Database identifiers
- CAS
248582-68-5- PubChem CID
- 5483874
- DTXSID
DTXSID00861370- ChEMBL
CHEMBL2268524- Nikkaji
- J1.157.567F、J1.641.072A
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 410
Experimental & physicochemical properties
PesticidesEnvironmental transformation -> Pesticides (parent, predecessor)
Collision Cross Section172.3 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID2032558]
Chemistry & industry
Uses & manufacturing
Use ClassificationEnvironmental transformation -> Pesticides (parent, predecessor)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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