Basic information
- CAS
106989-59-7- Standard SMILES
CCCCCCCOc1ccc(C(C)N)cc1- InChIKey
QVKVIGRBJWHCGH-UHFFFAOYSA-N- Molecular formula
- C15H25NO
- Average molar mass
- 235.36 g/mol
- Monoisotopic mass
- 235.19361442
Names & identifiers
- Preferred name
- Benzylamine, p-(heptyloxy)-alpha-methyl-
- IUPAC
- 1-(4-heptoxyphenyl)ethanamine
Names & synonyms
p-(Heptyloxy)-alpha-methylbenzylamine106989-59-7BENZYLAMINE, p-(HEPTYLOXY)-alpha-METHYL-RefChem:328839SCHEMBL8501526DTXSID30910204AKOS0052892931-[4-(Heptyloxy)phenyl]ethan-1-amine
Database identifiers
- CAS
106989-59-7- PubChem CID
- 60178
- DTXSID
DTXSID30910204
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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