p-(Hexyloxy)-alpha-methylbenzylamine
Basic information
- CAS
107916-76-7- Standard SMILES
CCCCCCOc1ccc(C(C)N)cc1- InChIKey
RLRTXNKPHNALGI-UHFFFAOYSA-N- Molecular formula
- C14H23NO
- Average molar mass
- 221.34 g/mol
- Monoisotopic mass
- 221.17796436
Names & identifiers
- Preferred name
- p-(Hexyloxy)-alpha-methylbenzylamine
- IUPAC
- 1-(4-hexoxyphenyl)ethanamine
- English name
- 1-(4-hexoxyphenyl)ethanamine
- Molecular formula
- C14H23NO
- Molecular weight
- 221.34
Names & synonyms
107916-76-7p-(Hexyloxy)-alpha-methylbenzylamine1-(4-hexoxyphenyl)ethanamineBRN 3260505BENZYLAMINE, p-(HEXYLOXY)-alpha-METHYL-DTXSID709105861-[4-(Hexyloxy)phenyl]ethan-1-amineBenzenemethanamine, 4-(hexyloxy)-α-methyl-
Database identifiers
- CAS
107916-76-7- PubChem CID
- 60200
- DTXSID
DTXSID70910586
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 164
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Compound notes
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