Isamidofos
Basic information
- CAS
66602-87-7- Standard SMILES
CCOP(=O)(NC(C)C)SCC(=O)N(C)c1ccccc1- InChIKey
ULNWEXDKQHEUSK-UHFFFAOYSA-N- Molecular formula
- C14H23N2O3PS
- Average molar mass
- 330.38 g/mol
- Monoisotopic mass
- 330.11670077
Names & identifiers
- Preferred name
- Isamidofos
- IUPAC
- 2-[ethoxy-(propan-2-ylamino)phosphoryl]sulfanyl-N-methyl-N-phenylacetamide
Names & synonyms
IsamidofosIsamidofos [ISO]UNII-41HX9F343H41HX9F343HHOE 3627566602-87-7DTXSID4058152(RS)-(O-ETHYL S-(N-METHYLCARBANILOYLMETHYL) N-ISOPROPYLPHOSPHORAMIDOTHIOATE)O-ETHYL S-(2-(METHYLPHENYLAMINO)-2-OXOETHYL) N-(1-METHYLETHYL)PHOSPHORAMIDOTHIOATERefChem:148884DTXCID0031920SCHEMBL160141
Show more names
Q27258435O-Ethyl S-{2-[methyl(phenyl)amino]-2-oxoethyl} N-(propan-2-yl)phosphoramidothioate
Database identifiers
- CAS
66602-87-7- PubChem CID
- 12907347
- DTXSID
DTXSID4058152- UNII
- 41HX9F343H
- Nikkaji
- J632.570J
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 83.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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