Basic information
- CAS
18470-10-5- Standard SMILES
COP(=S)(OC)OC1C2(C)CCC(C2)C1(C)C- InChIKey
NVBALASSUPWCIF-UHFFFAOYSA-N- Molecular formula
- C12H23O3PS
- Average molar mass
- 278.35 g/mol
- Monoisotopic mass
- 278.11055276
Names & identifiers
- Preferred name
- Phosphorothioic acid, O,O-dimethyl O-(1,3,3-trimethyl-2-norbornyl) ester
- IUPAC
- dimethoxy-sulfanylidene-[(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]-λ5-phosphane
Names & synonyms
O,O-Dimethyl O-(1,3,3-trimethyl-2-norbornyl)phosphorothioatePhosphorothioic acid, O,O-dimethyl O-(1,3,3-trimethyl-2-norbornyl) ester18470-10-5RefChem:371349DTXSID90939875O,O-Dimethyl O-(1,3,3-trimethylbicyclo[2.2.1]heptan-2-yl) phosphorothioate
Database identifiers
- CAS
18470-10-5- PubChem CID
- 205683
- DTXSID
DTXSID90939875
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…