Basic information
- CAS
73987-21-0- Standard SMILES
CCCCOP(=O)(OCCCC)C(CCC)OP1SCCS1- InChIKey
JFIGJMWLQHBEQR-UHFFFAOYSA-N- Molecular formula
- C14H30O4P2S2
- Average molar mass
- 388.5 g/mol
- Monoisotopic mass
- 388.10607578
Names & identifiers
- Preferred name
- 1,3,2-Dithiaphospholane, 2-(1-(dibutoxyphosphinyl)butoxy)-
- IUPAC
- 2-(1-dibutoxyphosphorylbutoxy)-1,3,2-dithiaphospholane
- English name
- [1-[(1,3,2-Dithiaphospholan-2-yl)oxy]butyl]phosphonic acid dibutyl ester
- Molecular formula
- C14H30O4P2S2
- Molecular weight
- 0
Names & synonyms
73987-21-02-(1-(Dibutoxyphosphinyl)butoxy)-1,3,2-dithiaphospholane1,3,2-DITHIAPHOSPHOLANE, 2-(1-(DIBUTOXYPHOSPHINYL)BUTOXY)-RefChem:216667DTXSID70995257Dibutyl {1-[(1,3,2-dithiaphospholan-2-yl)oxy]butyl}phosphonate2-(1-dibutoxyphosphorylbutoxy)-1,3,2-dithiaphospholane[1-[(1,3,2-Dithiaphospholan-2-yl)oxy]butyl]phosphonic acid dibutyl ester
Database identifiers
- CAS
73987-21-0- PubChem CID
- 52852
- DTXSID
DTXSID70995257- Nikkaji
- J87.571F
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 95.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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