4-(Tert-butoxy)-2-methylaniline
Basic information
- CAS
676366-01-1- Standard SMILES
Cc1cc(OC(C)(C)C)ccc1N- InChIKey
FKTSJBFQWWUQOH-UHFFFAOYSA-N- Molecular formula
- C11H17NO
- Average molar mass
- 179.26 g/mol
- Monoisotopic mass
- 179.13101417
Names & identifiers
- Preferred name
- 4-(Tert-butoxy)-2-methylaniline
- IUPAC
- 2-methyl-4-[(2-methylpropan-2-yl)oxy]aniline
Names & synonyms
4-(tert-butoxy)-2-methylaniline676366-01-14-tert-Butoxy-2-methylanilineBenzenamine, 4-(1,1-dimethylethoxy)-2-methyl-4-tert-butoxy-2-methyl-anilineDTXSID80653477CS-0284062EN300-1295161
Database identifiers
- CAS
676366-01-1- PubChem CID
- 39205256
- DTXSID
DTXSID80653477
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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