2-Methyl-5-propoxyaniline
Basic information
- CAS
918445-06-4- Standard SMILES
CCCOc1ccc(C)c(N)c1- InChIKey
POIUBBFYVAZOLB-UHFFFAOYSA-N- Molecular formula
- C10H15NO
- Average molar mass
- 165.23 g/mol
- Monoisotopic mass
- 165.1153641
Names & identifiers
- Preferred name
- 2-Methyl-5-propoxyaniline
- IUPAC
- 2-methyl-5-propoxyaniline
Names & synonyms
2-methyl-5-propoxyaniline918445-06-4Methyl-5-propoxybenzenamine2-Methyl-5-propoxybenzenamineSCHEMBL4227827DTXSID50653560POIUBBFYVAZOLB-UHFFFAOYSA-N
Database identifiers
- CAS
918445-06-4- PubChem CID
- 39236019
- DTXSID
DTXSID50653560
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 127
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Compound notes
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