Basic information
- CAS
505-13-5- Standard SMILES
N#CSCCF- InChIKey
YCDXXCPZKJPBTE-UHFFFAOYSA-N- Molecular formula
- C3H4FNS
- Average molar mass
- 105.14 g/mol
- Monoisotopic mass
- 105.00484847
Names & identifiers
- Preferred name
- 2-Fluoroethyl thiocyanate
- IUPAC
- 2-fluoroethyl thiocyanate
- English name
- Thiocyanic acid 2-fluoroethyl ester
- Molecular formula
- C3H4FNS
- Molecular weight
- 105.13
Names & synonyms
2-Fluoroethyl thiocyanate505-13-5DTXSID00964714RefChem:1063118DTXCID301392403Thiocyanic acid, 2-fluoroethyl esterBRN 1741708Thiocyanic acid 2-fluoroethyl ester
Database identifiers
- CAS
505-13-5- PubChem CID
- 68159
- DTXSID
DTXSID00964714- Nikkaji
- J48.847J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 64.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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