m-Toluidine, alpha-methoxy-4-(octyloxy)-, hydrochloride
Basic information
- CAS
5804-05-7- Standard SMILES
CCCCCCCCOc1ccc(N)cc1COC.Cl- InChIKey
DSBQHPYCEAPGDM-UHFFFAOYSA-N- Molecular formula
- C16H28ClNO2
- Average molar mass
- 301.9 g/mol
- Monoisotopic mass
- 301.18085682
Names & identifiers
- Preferred name
- m-Toluidine, alpha-methoxy-4-(octyloxy)-, hydrochloride
- IUPAC
- 3-(methoxymethyl)-4-octoxyaniline;hydrochloride
Names & synonyms
m-Toluidine, alpha-methoxy-4-(octyloxy)-, hydrochloride5804-05-7M & B 5936DTXSID80206760alpha-Methoxy-4-(octyloxy)-m-toluidine hydrochlorideRefChem:351604DTXCID101292513-(Methoxymethyl)-4-(octyloxy)aniline hydrochloride3-(methoxymethyl)-4-octoxyaniline;hydrochloridestarbld0037079orb1985581AKOS040753172
Show more names
T335333-(Methoxymethyl)-4-(octyloxy)aniline--hydrogen chloride (1/1)
Database identifiers
- CAS
5804-05-7- PubChem CID
- 201316
- DTXSID
DTXSID80206760
Properties
Computed structural properties
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 211
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Compound notes
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