Phosphonic acid, (2-oxo-3-tetrahydrothienyl)-, dibenzyl ester
Basic information
- CAS
73805-83-1- Standard SMILES
O=C1SCCC1NP(=O)(OCc1ccccc1)OCc1ccccc1- InChIKey
HJZKRKJNSYCZJW-UHFFFAOYSA-N- Molecular formula
- C18H20NO4PS
- Average molar mass
- 377.4 g/mol
- Monoisotopic mass
- 377.08506629
Names & identifiers
- Preferred name
- Phosphonic acid, (2-oxo-3-tetrahydrothienyl)-, dibenzyl ester
- IUPAC
- 3-[bis(phenylmethoxy)phosphorylamino]thiolan-2-one
- English name
- N-(Tetrahydro-2-oxothiophen-3-yl)phosporamidic acid dibenzyl ester
- Molecular formula
- C18H20NO4PS
- Molecular weight
- 377.39
Names & synonyms
73805-83-1Phosphonic acid, (2-oxo-3-tetrahydrothienyl)-, dibenzyl esterRefChem:1095154O,O'-Dibenzyl-4-mercapto-2-phosphonaminobutyric acid lactoneNSC 2212913-[bis(phenylmethoxy)phosphorylamino]thiolan-2-oneNSC221291Phosphoramidic acid, (tetrahydro-2-oxo-3-thienyl)-, bis(phenylmethyl) esterPhosphonic acid, dibenzyl esterDTXSID201385053WLN: T5SVTJ CMPO&O1R&O1RNSC-221291
Show more names
N-(Tetrahydro-2-oxothiophen-3-yl)phosporamidic acid dibenzyl esterPhosphoramidic acid, (tetrahydro-2-oxo-3-thienyl)-, bis(phenylmethyl) ester (9CI)
Database identifiers
- CAS
73805-83-1- PubChem CID
- 99802
- DTXSID
DTXSID201385053- Nikkaji
- J92.093B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 452
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Related reactions
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Compound notes
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