Basic information
- CAS
24017-20-7- Standard SMILES
CCP(=S)(OC)SCN1C(=O)c2ccccc2C1=O- InChIKey
YBKYDCKBUSWFIS-UHFFFAOYSA-N- Molecular formula
- C12H14NO3PS2
- Average molar mass
- 315.4 g/mol
- Monoisotopic mass
- 315.01527265
Names & identifiers
- Preferred name
- Phosphonodithioic acid, ethyl-, O-methyl ester, S-ester with N-(mercaptomethyl)phthalimide
- IUPAC
- 2-[[ethyl(methoxy)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione
- English name
- Ethylphosphonodithioic acid O-methyl S-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl] ester
- Molecular formula
- C12H14NO3PS2
- Molecular weight
- 315.35
Names & synonyms
24017-20-7BRN 1540834O-Methyl-S-(phthalimidomethyl)-ethylphosphonodithioateN-(Mercaptomethyl)phthalimide-S-(O-methyl)-ethylphosphonodithioatePhosphonodithioic acid, ethyl-, O-methyl ester, S-ester with N-(mercaptomethyl)phthalimideRefChem:370681DTXSID40946857Ethylphosphonodithioic acid O-methyl S-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl] esterS-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl] O-methyl ethylphosphonodithioatePhosphonodithioic acid, ethyl-, O-methyl ester, S-ester with N-(mercaptomethyl)phthalimide (7CI,8CI)
Database identifiers
- CAS
24017-20-7- PubChem CID
- 90338
- DTXSID
DTXSID40946857- Nikkaji
- J50.325H
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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