Basic information
- CAS
15382-78-2- Standard SMILES
COc1cc(N)ccc1OCCCCCCCCc1ccccc1- InChIKey
VVHGKLSPTRDFLF-UHFFFAOYSA-N- Molecular formula
- C21H29NO2
- Average molar mass
- 327.5 g/mol
- Monoisotopic mass
- 327.21982917
Names & identifiers
- Preferred name
- m-Anisidine, 4-((8-phenyloctyl)oxy)-
- IUPAC
- 3-methoxy-4-(8-phenyloctoxy)aniline
- English name
- 3-methoxy-4-(8-phenyloctoxy)aniline
- Molecular formula
- C21H29NO2
- Molecular weight
- 327.46
Names & synonyms
15382-78-2m-ANISIDINE, 4-((8-PHENYLOCTYL)OXY)-4-((8-Phenyloctyl)oxy)-m-anisidineM & B 4863BRN 2816260DTXSID20165448RefChem:351511DTXCID60879393-methoxy-4-(8-phenyloctoxy)aniline3-methoxy-4-((8-phenyloctyl)oxy)aniline3-METHOXY-4-[(8-PHENYLOCTYL)OXY]ANILINEorb1985705
Show more names
Benzenamine, 3-methoxy-4-[(8-phenyloctyl)oxy]-
AKOS030582762T33193
Database identifiers
- CAS
15382-78-2- PubChem CID
- 27233
- DTXSID
DTXSID20165448
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 304
Physicochemical properties
- Boiling point
- 489.9 · 489.9±35.0 °C(Predicted)
- Density
- 1.036 · 1.036±0.06 g/cm3(Predicted)
- pka
- 4.8 · 4.80±0.10(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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