Pseudourea, 2-ethyl-2-thio-, ethylenebis(O-ethylphosphite) (2:1)
Basic information
- CAS
37031-94-0- Standard SMILES
CCOP(=O)(O)CCP(=O)(O)OCC.CCSC(=N)N.CCSC(=N)N- InChIKey
ASGNURJWDGFUQS-UHFFFAOYSA-N- Molecular formula
- C12H32N4O6P2S2
- Average molar mass
- 454.5 g/mol
- Monoisotopic mass
- 454.1238511
Names & identifiers
- Preferred name
- Pseudourea, 2-ethyl-2-thio-, ethylenebis(O-ethylphosphite) (2:1)
- IUPAC
- ethoxy-[2-[ethoxy(hydroxy)phosphoryl]ethyl]phosphinic acid;ethyl carbamimidothioate
Names & synonyms
2-Ethyl-2-thiopseudourea ethylenebis(O-ethylphosphite) (2:1)Ethylene-bis-O-ethylphosphite-bis-S-ethyl-isothiuronium37031-94-0Pseudourea, 2-ethyl-2-thio-, ethylenebis(O-ethylphosphite) (2:1)RefChem:375775DTXSID90958208Diethyl ethane-1,2-diylbis[hydrogen (phosphonate)]--ethyl carbamimidothioate (1/2)
Database identifiers
- CAS
37031-94-0- PubChem CID
- 216059
- DTXSID
DTXSID90958208
Properties
Computed structural properties
- Topological polar surface area
- 243 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 279
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Related reactions
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Compound notes
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