Basic information
- CAS
35231-36-8- Standard SMILES
Cc1cc(OCCN(C)C)c(C(C)C)cc1O- InChIKey
HJGRPZCEBPNMDU-UHFFFAOYSA-N- Molecular formula
- C14H23NO2
- Average molar mass
- 237.34 g/mol
- Monoisotopic mass
- 237.17287898
Names & identifiers
- Preferred name
- Desacetylmoxisylyte
- IUPAC
- 4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenol
- English name
- deacetylmoxisylyte
- Molecular formula
- C14H23NO2
- Molecular weight
- 237.34
Names & synonyms
Deacetylmoxisylyte35231-36-8DTXSID10188722DesacetylmoxisylyteRefChem:919913DTXCID701112134-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenolCARVACROL, 5-(2-(DIMETHYLAMINO)ETHOXY)-DeacetylthymoxamineDesacetylthymoxamine4-(2-(Dimethylamino)ethoxy)-5-isopropyl-2-methylphenolHJGRPZCEBPNMDU-UHFFFAOYSA-N
Show more names
5-(2-Dimethylaminoethoxy)carvacrolPhenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-
Phenol, 4-(2-(dimethylamino)ethoxy)-5-isopropyl-2-methyl-starbld0005305(2-(4-Hydroxy-2-isopropyl-5-methylphenoxy)ethyl)dimethylaminePhenol, 4-(2-(dimethylamino)ethoxy)-2-methyl-5-(1-methylethyl)-orb1986217SCHEMBL52070724-[2-(dimethylamino)ethoxy]-2-methyl-5-(propan-2-yl)phenolAKOS040751432
Database identifiers
- CAS
35231-36-8- PubChem CID
- 28093
- DTXSID
DTXSID10188722- Nikkaji
- J134.855H
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 218
Experimental & physicochemical properties
LogP2.93
Physicochemical properties
- Melting point
- 91 · 91-92 °C
- Boiling point
- 362.41 °C · 362.41°C (rough estimate)
- Density
- 0.9568 · 0.9568 (rough estimate)
- refractive index
- 1.528 · 1.5280 (estimate)
- pka
- 10.76 · 10.76±0.25(Predicted)
Chemistry & industry
Suppliers1 total
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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