Basic information
- CAS
830356-08-6- Standard SMILES
CC(C)(C)c1ccc(C[Se]C#N)cc1- InChIKey
CYAHPYMJGMFYMI-UHFFFAOYSA-N- Molecular formula
- C12H15NSe
- Average molar mass
- 252.22 g/mol
- Monoisotopic mass
- 253.03697
Names & identifiers
- Preferred name
- Selenocyanic acid, [4-(1,1-dimethylethyl)phenyl]methyl ester
- IUPAC
- (4-tert-butylphenyl)methyl selenocyanate
Names & synonyms
Selenocyanic acid, [4-(1,1-dimethylethyl)phenyl]methyl ester830356-08-6(4-tert-butylphenyl)methyl selenocyanateSCHEMBL30421703DTXSID30373097AKOS004909990
Database identifiers
- CAS
830356-08-6- PubChem CID
- 2755463
- DTXSID
DTXSID30373097
Properties
Computed structural properties
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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