(2-Tert-butyl-4-methoxyphenyl)methanamine
Basic information
- CAS
401615-92-7- Standard SMILES
COc1ccc(CN)c(C(C)(C)C)c1- InChIKey
AZBNYCHCBOHQFA-UHFFFAOYSA-N- Molecular formula
- C12H19NO
- Average molar mass
- 193.28 g/mol
- Monoisotopic mass
- 193.14666423
Names & identifiers
- Preferred name
- (2-Tert-butyl-4-methoxyphenyl)methanamine
- IUPAC
- (2-tert-butyl-4-methoxyphenyl)methanamine
Names & synonyms
(2-tert-butyl-4-methoxyphenyl)methanamine401615-92-7DTXSID80395906AKOS006272568[2-(tert-butyl)-4-methoxyphenyl]methylamineST509989031-(2-TERT-BUTYL-4-METHOXYPHENYL)METHANAMINE
Database identifiers
- CAS
401615-92-7- PubChem CID
- 3750163
- DTXSID
DTXSID80395906
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
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Compound notes
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