Basic information
- CAS
157981-65-2- Standard SMILES
CCC(N)c1ccc(OC(C)(C)C)cc1- InChIKey
BEOGJSUBFZNMAP-UHFFFAOYSA-N- Molecular formula
- C13H21NO
- Average molar mass
- 207.31 g/mol
- Monoisotopic mass
- 207.16231429
Names & identifiers
- Preferred name
- 1-(4-tert-Butoxyphenyl)propan-1-amine
- IUPAC
- 1-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-1-amine
Names & synonyms
DTXSID6012382981-(4-tert-Butoxyphenyl)propan-1-amine4-(1,1-Dimethylethoxy)-I+/--ethylbenzenemethanamine157981-65-2
Database identifiers
- CAS
157981-65-2- PubChem CID
- 82492416
- DTXSID
DTXSID601238298
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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